Iprazochrome
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This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- Iprazochrome
- DrugBank Accession Number
- DB13541
- Background
Not Available
- Type
- Small Molecule
- Groups
- Experimental
- Structure
- Weight
- Average: 264.285
Monoisotopic: 264.122240391 - Chemical Formula
- C12H16N4O3
- Synonyms
- Iprazochrome
- Iprazochromum
- Iprazocromo
Pharmacology
- Indication
Not Available
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- Pharmacodynamics
Not Available
- Mechanism of action
- Not Available
- Absorption
Not Available
- Volume of distribution
Not Available
- Protein binding
Not Available
- Metabolism
- Not Available
- Route of elimination
Not Available
- Half-life
Not Available
- Clearance
Not Available
- Adverse Effects
- Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.
- Toxicity
Not Available
- Pathways
- Not Available
- Pharmacogenomic Effects/ADRs
- Not Available
Interactions
- Drug Interactions
- This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Drug Interaction Integrate drug-drug
interactions in your software1,2-Benzodiazepine The risk or severity of CNS depression can be increased when 1,2-Benzodiazepine is combined with Iprazochrome. Acenocoumarol The risk or severity of adverse effects can be increased when Iprazochrome is combined with Acenocoumarol. Acetazolamide The risk or severity of CNS depression can be increased when Acetazolamide is combined with Iprazochrome. Acetophenazine The risk or severity of CNS depression can be increased when Acetophenazine is combined with Iprazochrome. Agomelatine The risk or severity of CNS depression can be increased when Agomelatine is combined with Iprazochrome. - Food Interactions
- Not Available
Categories
- ATC Codes
- N02CX03 — Iprazochrome
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as indoles and derivatives. These are organic compounds containing an indole, which is a bicyclic ring system made up of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
- Kingdom
- Organic compounds
- Super Class
- Organoheterocyclic compounds
- Class
- Indoles and derivatives
- Sub Class
- Not Available
- Direct Parent
- Indoles and derivatives
- Alternative Parents
- Semicarbazones / N-alkylpyrrolidines / Vinylogous amides / Trialkylamines / Secondary alcohols / Organic carbonic acids and derivatives / Cyclic ketones / Enamines / Azacyclic compounds / Organopnictogen compounds show 2 more
- Substituents
- Alcohol / Aliphatic heteropolycyclic compound / Amine / Azacycle / Carbonic acid derivative / Carbonyl group / Cyclic ketone / Enamine / Hydrocarbon derivative / Indole or derivatives show 15 more
- Molecular Framework
- Aliphatic heteropolycyclic compounds
- External Descriptors
- Not Available
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- 903A9K181P
- CAS number
- 7248-21-7
- InChI Key
- XZKVIDLLLOUTSS-ZSOIEALJSA-N
- InChI
- InChI=1S/C12H16N4O3/c1-6(2)16-5-11(18)7-3-8(14-15-12(13)19)10(17)4-9(7)16/h3-4,6,11,18H,5H2,1-2H3,(H3,13,15,19)/b14-8-
- IUPAC Name
- {[(5Z)-3-hydroxy-6-oxo-1-(propan-2-yl)-2,3,5,6-tetrahydro-1H-indol-5-ylidene]amino}urea
- SMILES
- CC(C)N1CC(O)C2=C\C(=N\NC(N)=O)C(=O)C=C12
References
- General References
- Not Available
- External Links
- ChemSpider
- 4903581
- 51486
- ChEMBL
- CHEMBL2104324
- Wikipedia
- Iprazochrome
Clinical Trials
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
- Not Available
- Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Not Available
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source Water Solubility 1.42 mg/mL ALOGPS logP 0.31 ALOGPS logP -0.45 Chemaxon logS -2.3 ALOGPS pKa (Strongest Acidic) 11.64 Chemaxon pKa (Strongest Basic) 2.12 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 108.02 Å2 Chemaxon Rotatable Bond Count 2 Chemaxon Refractivity 71.32 m3·mol-1 Chemaxon Polarizability 26.87 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
Spectrum Spectrum Type Splash Key Predicted GC-MS Spectrum - GC-MS Predicted GC-MS splash10-0006-6970000000-48425fcc481546ccf637 Predicted MS/MS Spectrum - 10V, Positive (Annotated) Predicted LC-MS/MS splash10-014j-0090000000-ccae0879b5b71cb1bee9 Predicted MS/MS Spectrum - 10V, Negative (Annotated) Predicted LC-MS/MS splash10-0006-0910000000-a13a911ffd9bdb577520 Predicted MS/MS Spectrum - 20V, Positive (Annotated) Predicted LC-MS/MS splash10-0aor-0790000000-be0cc032c71311315f15 Predicted MS/MS Spectrum - 20V, Negative (Annotated) Predicted LC-MS/MS splash10-0umi-0980000000-fc8187b52a4aa3dd0a45 Predicted MS/MS Spectrum - 40V, Positive (Annotated) Predicted LC-MS/MS splash10-08g0-3920000000-20affe4fe1c5d69ee655 Predicted MS/MS Spectrum - 40V, Negative (Annotated) Predicted LC-MS/MS splash10-03di-2920000000-5481515f4149155356e1 Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 164.03816 predictedDeepCCS 1.0 (2019) [M+H]+ 166.39616 predictedDeepCCS 1.0 (2019) [M+Na]+ 172.48932 predictedDeepCCS 1.0 (2019)
Drug created at June 23, 2017 20:43 / Updated at February 21, 2021 18:54