N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide
TL;DR: N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide (CAS 130138-87-3) is a chemical compound with molecular formula C15H15NO2S and molecular weight 273.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(hydroxymethyl)phenyl]sulfanyl-N-methylbenzamide
Also Known As: N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide, 2-[2-(hydroxymethyl)phenyl]sulfanyl-N-methylbenzamide, N-methyl-2-[(2-methylolphenyl)thio]benzamide, 2-((2-(Hydroxymethyl)phenyl)thio)-N-methylbenzamide, 2-[[2-(hydroxymethyl)phenyl]thio]-N-methylbenzamide
| Molecular Formula | C15H15NO2S |
|---|---|
| Molecular Weight | 273.08 g/mol |
| LogP | 2.6897 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.08234 |
| Heavy Atoms | 19 |
| Complexity | 583.86316 |
Chemical Identifiers
| CAS Number | 130138-87-3 |
|---|---|
| SMILES | CNC(=O)C1=CC=CC=C1SC2=CC=CC=C2CO |
Product Overview
N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide (CAS 130138-87-3), with molecular formula C15H15NO2S and molecular weight 273.08 g/mol. IUPAC: 2-[2-(hydroxymethyl)phenyl]sulfanyl-N-methylbenzamide.
Chemical Property Profile of N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide
Property Insights of N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide
The XLogP value of 2.6897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide. With a topological polar surface area (TPSA) of 49.33 Ų, N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide has 2 hydrogen bond donor(s) and 3 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 N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide?
The CAS number of N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide is 130138-87-3.
What is the molecular formula of N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide?
The molecular formula of N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide is C15H15NO2S.
What is the molecular weight of N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide?
The molecular weight of N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide is 273.08 g/mol.
Where can I buy N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide?
You can request a quote for N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide?
Yes, KEHONG BIO provides custom synthesis services for N1-methyl-2-{[2-(hydroxymethyl)phenyl]thio}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.