2-(benzylsulfanyl)-N-methylpropanamide
TL;DR: 2-(benzylsulfanyl)-N-methylpropanamide (CAS 87122-96-1) is a chemical compound with molecular formula C11H15NOS and molecular weight 209.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-N-methylpropanamide
Also Known As: 2-(benzylsulfanyl)-N-methylpropanamide, 2-benzylsulfanyl-N-methylpropanamide, 2-Benzylsulfanyl-N-methyl-propionamide, N-methyl-2-(phenylmethylthio)propanamide, BAS 02209346
| Molecular Formula | C11H15NOS |
|---|---|
| Molecular Weight | 209.09 g/mol |
| LogP | 2.0543 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.08743 |
| Heavy Atoms | 14 |
| Complexity | 286.59882 |
Chemical Identifiers
| CAS Number | 87122-96-1 |
|---|---|
| SMILES | CC(C(=O)NC)SCC1=CC=CC=C1 |
Product Overview
2-(benzylsulfanyl)-N-methylpropanamide (CAS 87122-96-1), with molecular formula C11H15NOS and molecular weight 209.09 g/mol. IUPAC: 2-benzylsulfanyl-N-methylpropanamide.
Chemical Property Profile of 2-(benzylsulfanyl)-N-methylpropanamide
Property Insights of 2-(benzylsulfanyl)-N-methylpropanamide
The XLogP value of 2.0543 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(benzylsulfanyl)-N-methylpropanamide. With a topological polar surface area (TPSA) of 29.1 Ų, 2-(benzylsulfanyl)-N-methylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(benzylsulfanyl)-N-methylpropanamide 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-(benzylsulfanyl)-N-methylpropanamide?
The CAS number of 2-(benzylsulfanyl)-N-methylpropanamide is 87122-96-1.
What is the molecular formula of 2-(benzylsulfanyl)-N-methylpropanamide?
The molecular formula of 2-(benzylsulfanyl)-N-methylpropanamide is C11H15NOS.
What is the molecular weight of 2-(benzylsulfanyl)-N-methylpropanamide?
The molecular weight of 2-(benzylsulfanyl)-N-methylpropanamide is 209.09 g/mol.
Where can I buy 2-(benzylsulfanyl)-N-methylpropanamide?
You can request a quote for 2-(benzylsulfanyl)-N-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(benzylsulfanyl)-N-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(benzylsulfanyl)-N-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.