2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-
TL;DR: 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- (CAS 87744-52-3) is a chemical compound with molecular formula C11H14N2OS and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxyethyl)-4,5-dihydro-1H-1,3-benzodiazepine-2-thione
Also Known As: 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-, 1,3,4,5-Tetrahydro-3-(2-hydroxyethyl)-2H-1,3-benzodiazepine-2-thione, (Hydroxy-2 ethyl)-3 tetrahydro-1,3,4,5 2H-benzodiazepine-1,3 thione-2 [French], (Hydroxy-2 ethyl)-3 tetrahydro-1,3,4,5 2H-benzodiazepine-1,3 thione-2, 3-(2-hydroxyethyl)-4,5-dihydro-1H-1,3-benzodiazepine-2-thione
| Molecular Formula | C11H14N2OS |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 1.2338 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.08269 |
| Heavy Atoms | 15 |
| Complexity | 367.36047 |
Chemical Identifiers
| CAS Number | 87744-52-3 |
|---|---|
| SMILES | C1CN(C(=S)NC2=CC=CC=C21)CCO |
Product Overview
2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- (CAS 87744-52-3), with molecular formula C11H14N2OS and molecular weight 222.08 g/mol. IUPAC: 3-(2-hydroxyethyl)-4,5-dihydro-1H-1,3-benzodiazepine-2-thione.
Chemical Property Profile of 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-
Property Insights of 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-
The XLogP value of 1.2338 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-. With a topological polar surface area (TPSA) of 35.5 Ų, 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- 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 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-?
The CAS number of 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- is 87744-52-3.
What is the molecular formula of 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-?
The molecular formula of 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- is C11H14N2OS.
What is the molecular weight of 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-?
The molecular weight of 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- is 222.08 g/mol.
Where can I buy 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-?
You can request a quote for 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3-Benzodiazepine-2-thione, 1,3,4,5-tetrahydro-3-(2-hydroxyethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.