N-(2-hydroxypropyl)benzenecarbothioamide
TL;DR: N-(2-hydroxypropyl)benzenecarbothioamide (CAS 92877-45-7) is a chemical compound with molecular formula C10H13NOS and molecular weight 195.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-hydroxypropyl)benzenecarbothioamide
Also Known As: N-(2-hydroxypropyl)benzenecarbothioamide, 5-Bromo-2-chlorobenzyl chloride, N-(2-Hydroxypropyl)thiobenzamide, J1.824.412H
| Molecular Formula | C10H13NOS |
|---|---|
| Molecular Weight | 195.07 g/mol |
| LogP | 1.3325 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.0718 |
| Heavy Atoms | 13 |
| Complexity | 271.51306 |
Chemical Identifiers
| CAS Number | 92877-45-7 |
|---|---|
| SMILES | CC(CNC(=S)C1=CC=CC=C1)O |
Product Overview
N-(2-hydroxypropyl)benzenecarbothioamide (CAS 92877-45-7), with molecular formula C10H13NOS and molecular weight 195.07 g/mol. IUPAC: N-(2-hydroxypropyl)benzenecarbothioamide.
Chemical Property Profile of N-(2-hydroxypropyl)benzenecarbothioamide
Property Insights of N-(2-hydroxypropyl)benzenecarbothioamide
The XLogP value of 1.3325 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-hydroxypropyl)benzenecarbothioamide. With a topological polar surface area (TPSA) of 32.26 Ų, N-(2-hydroxypropyl)benzenecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-hydroxypropyl)benzenecarbothioamide 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 N-(2-hydroxypropyl)benzenecarbothioamide?
The CAS number of N-(2-hydroxypropyl)benzenecarbothioamide is 92877-45-7.
What is the molecular formula of N-(2-hydroxypropyl)benzenecarbothioamide?
The molecular formula of N-(2-hydroxypropyl)benzenecarbothioamide is C10H13NOS.
What is the molecular weight of N-(2-hydroxypropyl)benzenecarbothioamide?
The molecular weight of N-(2-hydroxypropyl)benzenecarbothioamide is 195.07 g/mol.
Where can I buy N-(2-hydroxypropyl)benzenecarbothioamide?
You can request a quote for N-(2-hydroxypropyl)benzenecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-hydroxypropyl)benzenecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-hydroxypropyl)benzenecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.