3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide
TL;DR: 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide (CAS 879080-01-0) is a chemical compound with molecular formula C16H15ClN2O3S and molecular weight 350.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide
Also Known As: 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide, 3-[(4-chlorophenyl)sulfanyl]-N-(2-methyl-4-nitrophenyl)propanamide, 3-(4-chlorophenylthio)-N-(2-methyl-4-nitrophenyl)propanamide
| Molecular Formula | C16H15ClN2O3S |
|---|---|
| Molecular Weight | 350.05 g/mol |
| LogP | 4.67752 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.0492 |
| Heavy Atoms | 23 |
| Complexity | 719.7653 |
Chemical Identifiers
| CAS Number | 879080-01-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CCSC2=CC=C(C=C2)Cl |
Product Overview
3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide (CAS 879080-01-0), with molecular formula C16H15ClN2O3S and molecular weight 350.05 g/mol. IUPAC: 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide.
Chemical Property Profile of 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide
Property Insights of 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide
The XLogP value of 4.67752 indicates that 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide. Following Lipinski's Rule of Five, 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide has 1 hydrogen bond donor(s) and 4 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-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide?
The CAS number of 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide is 879080-01-0.
What is the molecular formula of 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide?
The molecular formula of 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide is C16H15ClN2O3S.
What is the molecular weight of 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide?
The molecular weight of 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide is 350.05 g/mol.
Where can I buy 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide?
You can request a quote for 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-chlorophenyl)sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.