2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-
TL;DR: 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- (CAS 123229-16-3) is a chemical compound with molecular formula C11H14N2S and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-3,4-dihydro-1H-1,5-benzodiazepine-2-thione
Also Known As: 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-, 4,5-dimethyl-3,4-dihydro-1H-1,5-benzodiazepine-2-thione, 4,5-Dimethyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione, 4,5-dimethyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-2-thione, 2,3-dimethyl-2,6-diazabicyclo[5.4.0]undeca-7,9,11-triene-5-thione
| Molecular Formula | C11H14N2S |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 2.6543 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 206.08777 |
| Heavy Atoms | 14 |
| Complexity | 362.0601 |
Chemical Identifiers
| CAS Number | 123229-16-3 |
|---|---|
| SMILES | CC1CC(=S)NC2=CC=CC=C2N1C |
Product Overview
2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- (CAS 123229-16-3), with molecular formula C11H14N2S and molecular weight 206.09 g/mol. IUPAC: 4,5-dimethyl-3,4-dihydro-1H-1,5-benzodiazepine-2-thione.
Chemical Property Profile of 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-
Property Insights of 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-
The XLogP value of 2.6543 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-. With a topological polar surface area (TPSA) of 15.27 Ų, 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- 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 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-?
The CAS number of 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- is 123229-16-3.
What is the molecular formula of 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-?
The molecular formula of 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- is C11H14N2S.
What is the molecular weight of 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-?
The molecular weight of 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- is 206.09 g/mol.
Where can I buy 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-?
You can request a quote for 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,5-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-4,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.