Guanoclor sulfateProduct ingredient for Guanoclor
- Name
- Guanoclor sulfate
- Drug Entry
- Guanoclor
- Accession Number
- DBSALT002915
- Structure
Structure for Guanoclor sulfate (DBSALT002915)
- Synonyms
- Guanoclor sulfate
- External IDs
- 3-01029
- UNII
- Q1U97XK18R
- CAS Number
- 551-48-4
- Weight
- Average: 624.32
Monoisotopic: 622.0450126 - Chemical Formula
- C18H26Cl4N8O6S
- InChI Key
- OLLMPVQGLMNQQK-UHFFFAOYSA-N
- InChI
- InChI=1S/2C9H12Cl2N4O.H2O4S/c2*10-6-2-1-3-7(11)8(6)16-5-4-14-15-9(12)13;1-5(2,3)4/h2*1-3,14H,4-5H2,(H4,12,13,15);(H2,1,2,3,4)
- IUPAC Name
- bis(N-{[2-(2,6-dichlorophenoxy)ethyl]amino}guanidine); sulfuric acid
- SMILES
- OS(O)(=O)=O.NC(=N)NNCCOC1=C(Cl)C=CC=C1Cl.NC(=N)NNCCOC1=C(Cl)C=CC=C1Cl
- External Links
- ChemSpider
- 19989853
- ChEMBL
- CHEMBL3989456
- Predicted Properties
Property Value Source Water Solubility 0.392 mg/mL ALOGPS logP 0.99 ALOGPS logP 1.61 Chemaxon logS -2.8 ALOGPS pKa (Strongest Basic) 11.22 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 4 Chemaxon Polar Surface Area 83.16 Å2 Chemaxon Rotatable Bond Count 10 Chemaxon Refractivity 95.32 m3·mol-1 Chemaxon Polarizability 25 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon