去甲基氯巴占
TL;DR: 去甲基氯巴占 (CAS 22316-55-8) is a chemical compound with molecular formula C15H11ClN2O2 and molecular weight 286.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
去甲基氯巴占
7-chloro-5-phenyl-1H-1,5-benzodiazepine-2,4-dione
Also Known As: Norclobazam, N-Desmethylclobazam, Desmethylclobazam, Clofazin, Demethylclobazam
| Molecular Formula | C15H11ClN2O2 |
|---|---|
| Molecular Weight | 286.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 286.0509 |
| Heavy Atoms | 20 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 22316-55-8 |
|---|---|
| SMILES | C1C(=O)NC2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3 |
| InChIKey | RRTVVRIFVKKTJK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
去甲基氯巴占 (CAS 22316-55-8), with molecular formula C15H11ClN2O2 and molecular weight 286.05 g/mol. IUPAC: 7-chloro-5-phenyl-1H-1,5-benzodiazepine-2,4-dione.
Chemical Property Profile of 去甲基氯巴占
Property Insights of 去甲基氯巴占
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 去甲基氯巴占. With a topological polar surface area (TPSA) of 49.4 Ų, 去甲基氯巴占 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 去甲基氯巴占 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 去甲基氯巴占?
The CAS number of 去甲基氯巴占 is 22316-55-8.
What is the molecular formula of 去甲基氯巴占?
The molecular formula of 去甲基氯巴占 is C15H11ClN2O2.
What is the molecular weight of 去甲基氯巴占?
The molecular weight of 去甲基氯巴占 is 286.05 g/mol.
Where can I buy 去甲基氯巴占?
You can request a quote for 去甲基氯巴占 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 去甲基氯巴占?
Yes, KEHONG BIO provides custom synthesis services for 去甲基氯巴占 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.