N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide
TL;DR: N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide (CAS 667875-71-0) is a chemical compound with molecular formula C14H21NOS and molecular weight 251.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide
Also Known As: N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide, N-(sec-butyl)-3-[(4-methylphenyl)sulfanyl]propanamide, AO-081/41756115, N-(butan-2-yl)-3-[(4-methylphenyl)sulfanyl]propanamide
| Molecular Formula | C14H21NOS |
|---|---|
| Molecular Weight | 251.13 g/mol |
| LogP | 3.39192 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 251.13438 |
| Heavy Atoms | 17 |
| Complexity | 347.74478 |
Chemical Identifiers
| CAS Number | 667875-71-0 |
|---|---|
| SMILES | CCC(C)NC(=O)CCSC1=CC=C(C=C1)C |
Product Overview
N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide (CAS 667875-71-0), with molecular formula C14H21NOS and molecular weight 251.13 g/mol. IUPAC: N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide.
Chemical Property Profile of N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide
Property Insights of N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide
The XLogP value of 3.39192 indicates that N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide 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 N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide?
The CAS number of N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide is 667875-71-0.
What is the molecular formula of N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide?
The molecular formula of N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide is C14H21NOS.
What is the molecular weight of N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide?
The molecular weight of N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide is 251.13 g/mol.
Where can I buy N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide?
You can request a quote for N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-butan-2-yl-3-(4-methylphenyl)sulfanylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.