5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione
TL;DR: 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione (CAS 32047-76-0) is a chemical compound with molecular formula C13H10N2S and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,11-dihydrobenzo[b][1,4]benzodiazepine-6-thione
Also Known As: 11H-DIBENZO(b,e)(1,4)DIAZEPINE-11-THIONE, 5,10-DIHYDRO-, 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione, 5-24-04-00115 (Beilstein Handbook Reference), 5H-Dibenzo[b,e][1,4]diazepine-11(10H)-thione, 5,11-dihydrobenzo[b][1,4]benzodiazepine-6-thione
| Molecular Formula | C13H10N2S |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 3.5312 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.05647 |
| Heavy Atoms | 16 |
| Complexity | 563.36395 |
Chemical Identifiers
| CAS Number | 32047-76-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=S)NC3=CC=CC=C3N2 |
Product Overview
5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione (CAS 32047-76-0), with molecular formula C13H10N2S and molecular weight 226.06 g/mol. IUPAC: 5,11-dihydrobenzo[b][1,4]benzodiazepine-6-thione.
Chemical Property Profile of 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione
Property Insights of 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione
The XLogP value of 3.5312 indicates that 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione has 2 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 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione?
The CAS number of 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione is 32047-76-0.
What is the molecular formula of 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione?
The molecular formula of 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione is C13H10N2S.
What is the molecular weight of 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione?
The molecular weight of 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione is 226.06 g/mol.
Where can I buy 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione?
You can request a quote for 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione?
Yes, KEHONG BIO provides custom synthesis services for 5,10-Dihydro-11H-dibenzo(b,e)(1,4)diazepine-11-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.