Ethoheptazine hydrochlorideProduct ingredient for Ethoheptazine
- Name
- Ethoheptazine hydrochloride
- Drug Entry
- Ethoheptazine
Ethoheptazine is marketed under the name Zactane. It is a phenazepine based opioid analgesic. It was invented in the 1950s and is related to other drugs such as proheptazine. Ethoheptazine is no longer marketed in the United States.
- Accession Number
- DBSALT002450
- Structure
- Synonyms
- Ethoheptazine HCl
- UNII
- 8KYO8O8JNO
- CAS Number
- 5982-61-6
- Weight
- Average: 297.82
Monoisotopic: 297.1495567 - Chemical Formula
- C16H24ClNO2
- InChI Key
- XHRYXPJUXHWWJD-UHFFFAOYSA-N
- InChI
- InChI=1S/C16H23NO2.ClH/c1-3-19-15(18)16(14-8-5-4-6-9-14)10-7-12-17(2)13-11-16;/h4-6,8-9H,3,7,10-13H2,1-2H3;1H
- IUPAC Name
- ethyl 1-methyl-4-phenylazepane-4-carboxylate hydrochloride
- SMILES
- Cl.CCOC(=O)C1(CCCN(C)CC1)C1=CC=CC=C1
- External Links
- ChemSpider
- 19952555
- ChEMBL
- CHEMBL3186813
- Predicted Properties
Property Value Source Water Solubility 0.575 mg/mL ALOGPS logP 3.32 ALOGPS logP 2.9 Chemaxon logS -2.7 ALOGPS pKa (Strongest Basic) 8.69 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 29.54 Å2 Chemaxon Rotatable Bond Count 4 Chemaxon Refractivity 77.08 m3·mol-1 Chemaxon Polarizability 29.92 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon