![2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid structure](/static/products/3384/338409-04-4.webp)
2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid
TL;DR: 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid (CAS 338409-04-4) is a chemical compound with molecular formula C10H10ClNO3S and molecular weight 259.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylacetic acid
Also Known As: 2-({[(4-chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid, ({2-[(4-chlorophenyl)amino]-2-oxoethyl}thio)acetic acid, 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylacetic acid, 2-{[2-(4-chloroanilino)-2-oxoethyl]sulfanyl}acetic acid, ((2-[(4-chlorophenyl)amino]-2-oxoethyl)thio)acetic acid
| Molecular Formula | C10H10ClNO3S |
|---|---|
| Molecular Weight | 259.01 g/mol |
| LogP | 2.0963 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 259.007 |
| Heavy Atoms | 16 |
| Complexity | 380.15546 |
Chemical Identifiers
| CAS Number | 338409-04-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CSCC(=O)O)Cl |
Product Overview
2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid (CAS 338409-04-4), with molecular formula C10H10ClNO3S and molecular weight 259.01 g/mol. IUPAC: 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylacetic acid.
Chemical Property Profile of 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid
Property Insights of 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid
The XLogP value of 2.0963 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid. Following Lipinski's Rule of Five, 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid 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 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid?
The CAS number of 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid is 338409-04-4.
What is the molecular formula of 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid?
The molecular formula of 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid is C10H10ClNO3S.
What is the molecular weight of 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid?
The molecular weight of 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid is 259.01 g/mol.
Where can I buy 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid?
You can request a quote for 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({[(4-Chlorophenyl)carbamoyl]methyl}sulfanyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.