N-Desmethylquazepam
TL;DR: N-Desmethylquazepam (CAS 1645-32-5) is a chemical compound with molecular formula C15H10ClFN2S and molecular weight 304.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-5-(2-fluorophenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione
Also Known As: N-Desmethylquazepam, Desalkylquazepam, 7-chloro-5-(2-fluorophenyl)-1H-benzo[e][1,4]diazepine-2(3H)-thione, 7-chloro-5-(2-fluorophenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione, 7-chloro-5-(2-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepine-2-thione
| Molecular Formula | C15H10ClFN2S |
|---|---|
| Molecular Weight | 304.02 g/mol |
| LogP | 4.0694 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 304.0237 |
| Heavy Atoms | 20 |
| Complexity | 727.5635 |
Chemical Identifiers
| CAS Number | 1645-32-5 |
|---|---|
| SMILES | C1C(=S)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F |
Product Overview
N-Desmethylquazepam (CAS 1645-32-5), with molecular formula C15H10ClFN2S and molecular weight 304.02 g/mol. IUPAC: 7-chloro-5-(2-fluorophenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione.
Chemical Property Profile of N-Desmethylquazepam
Property Insights of N-Desmethylquazepam
The XLogP value of 4.0694 indicates that N-Desmethylquazepam is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.39 Ų, N-Desmethylquazepam exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Desmethylquazepam 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 N-Desmethylquazepam?
The CAS number of N-Desmethylquazepam is 1645-32-5.
What is the molecular formula of N-Desmethylquazepam?
The molecular formula of N-Desmethylquazepam is C15H10ClFN2S.
What is the molecular weight of N-Desmethylquazepam?
The molecular weight of N-Desmethylquazepam is 304.02 g/mol.
Where can I buy N-Desmethylquazepam?
You can request a quote for N-Desmethylquazepam directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Desmethylquazepam?
Yes, KEHONG BIO provides custom synthesis services for N-Desmethylquazepam and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.