2-Methylsulfanyl-benzamide
TL;DR: 2-Methylsulfanyl-benzamide (CAS 54705-16-7) is a chemical compound with molecular formula C8H9NOS and molecular weight 167.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylbenzamide
Also Known As: 2-methylsulfanyl-benzamide, 2-methylsulfanylbenzamide, 2-(methylsulfanyl)benzamide, 2-(methylthio)benzamide, (methyl-thio)benzamide
| Molecular Formula | C8H9NOS |
|---|---|
| Molecular Weight | 167.04 g/mol |
| LogP | 1.5074 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.04048 |
| Heavy Atoms | 11 |
| Complexity | 272.5495 |
Chemical Identifiers
| CAS Number | 54705-16-7 |
|---|---|
| SMILES | CSC1=CC=CC=C1C(=O)N |
Product Overview
2-Methylsulfanyl-benzamide (CAS 54705-16-7), with molecular formula C8H9NOS and molecular weight 167.04 g/mol. IUPAC: 2-methylsulfanylbenzamide.
Chemical Property Profile of 2-Methylsulfanyl-benzamide
Property Insights of 2-Methylsulfanyl-benzamide
The XLogP value of 1.5074 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylsulfanyl-benzamide. With a topological polar surface area (TPSA) of 43.09 Ų, 2-Methylsulfanyl-benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylsulfanyl-benzamide 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 2-Methylsulfanyl-benzamide?
The CAS number of 2-Methylsulfanyl-benzamide is 54705-16-7.
What is the molecular formula of 2-Methylsulfanyl-benzamide?
The molecular formula of 2-Methylsulfanyl-benzamide is C8H9NOS.
What is the molecular weight of 2-Methylsulfanyl-benzamide?
The molecular weight of 2-Methylsulfanyl-benzamide is 167.04 g/mol.
Where can I buy 2-Methylsulfanyl-benzamide?
You can request a quote for 2-Methylsulfanyl-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylsulfanyl-benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylsulfanyl-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.