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11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione
TL;DR: 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione (CAS 15980-61-7) is a chemical compound with molecular formula C14H12N2S and molecular weight 240.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione
Also Known As: 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione, 5-Methyl-5,10-dihydro-11H-dibenzo[b,e][1,4]diazepine-11-thione
| Molecular Formula | C14H12N2S |
|---|---|
| Molecular Weight | 240.07 g/mol |
| LogP | 3.5555 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.07211 |
| Heavy Atoms | 17 |
| Complexity | 592.281 |
Chemical Identifiers
| CAS Number | 15980-61-7 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=S)NC3=CC=CC=C31 |
Product Overview
11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione (CAS 15980-61-7), with molecular formula C14H12N2S and molecular weight 240.07 g/mol. IUPAC: 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione.
Chemical Property Profile of 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione
Property Insights of 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione
The XLogP value of 3.5555 indicates that 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.27 Ų, 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione 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 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione?
The CAS number of 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione is 15980-61-7.
What is the molecular formula of 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione?
The molecular formula of 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione is C14H12N2S.
What is the molecular weight of 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione?
The molecular weight of 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione is 240.07 g/mol.
Where can I buy 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione?
You can request a quote for 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione?
Yes, KEHONG BIO provides custom synthesis services for 11-methyl-5H-benzo[b][1,4]benzodiazepine-6-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.