3-(Benzylsulfanyl)-N-methylpropanamide
TL;DR: 3-(Benzylsulfanyl)-N-methylpropanamide (CAS 56788-03-5) 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.
3-benzylsulfanyl-N-methylpropanamide
Also Known As: 3-benzylsulfanyl-N-methylpropanamide, N-methyl 3-((phenylmethyl)thio)propanamide, 3-(BENZYLSULFANYL)-N-METHYLPROPANAMIDE
| Molecular Formula | C11H15NOS |
|---|---|
| Molecular Weight | 209.09 g/mol |
| LogP | 2.0559 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.08743 |
| Heavy Atoms | 14 |
| Complexity | 273.87582 |
Chemical Identifiers
| CAS Number | 56788-03-5 |
|---|---|
| SMILES | CNC(=O)CCSCC1=CC=CC=C1 |
Product Overview
3-(Benzylsulfanyl)-N-methylpropanamide (CAS 56788-03-5), with molecular formula C11H15NOS and molecular weight 209.09 g/mol. IUPAC: 3-benzylsulfanyl-N-methylpropanamide.
Chemical Property Profile of 3-(Benzylsulfanyl)-N-methylpropanamide
Property Insights of 3-(Benzylsulfanyl)-N-methylpropanamide
The XLogP value of 2.0559 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Benzylsulfanyl)-N-methylpropanamide. With a topological polar surface area (TPSA) of 29.1 Ų, 3-(Benzylsulfanyl)-N-methylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(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 3-(Benzylsulfanyl)-N-methylpropanamide?
The CAS number of 3-(Benzylsulfanyl)-N-methylpropanamide is 56788-03-5.
What is the molecular formula of 3-(Benzylsulfanyl)-N-methylpropanamide?
The molecular formula of 3-(Benzylsulfanyl)-N-methylpropanamide is C11H15NOS.
What is the molecular weight of 3-(Benzylsulfanyl)-N-methylpropanamide?
The molecular weight of 3-(Benzylsulfanyl)-N-methylpropanamide is 209.09 g/mol.
Where can I buy 3-(Benzylsulfanyl)-N-methylpropanamide?
You can request a quote for 3-(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 3-(Benzylsulfanyl)-N-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Benzylsulfanyl)-N-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.