Homocysteine, N-acetyl-S-(2-chloroethyl)-
TL;DR: Homocysteine, N-acetyl-S-(2-chloroethyl)- (CAS 36709-10-1) is a chemical compound with molecular formula C8H14ClNO3S and molecular weight 239.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-acetamido-4-(2-chloroethylsulfanyl)butanoic acid
Also Known As: Homocysteine, N-acetyl-S-(2-chloroethyl)-, n-acetyl-s-(2-chloroethyl)-l-homocysteine, N-acetyl-S-(2-chloroethyl)-DL-homocysteine, (2S)-2-acetamido-4-(2-chloroethylsulfanyl)butanoic Acid, 2-Acetylamino-4-(2-chloro-ethylsulfanyl)-butyric acid
| Molecular Formula | C8H14ClNO3S |
|---|---|
| Molecular Weight | 239.04 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 239.0383 |
| Heavy Atoms | 14 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 36709-10-1 |
|---|---|
| SMILES | CC(=O)N[C@@H](CCSCCCl)C(=O)O |
| InChIKey | GIKPDTMIMLDRLC-ZETCQYMHSA-N |
Product Overview
Homocysteine, N-acetyl-S-(2-chloroethyl)- (CAS 36709-10-1), with molecular formula C8H14ClNO3S and molecular weight 239.04 g/mol. IUPAC: (2S)-2-acetamido-4-(2-chloroethylsulfanyl)butanoic acid.
Chemical Property Profile of Homocysteine, N-acetyl-S-(2-chloroethyl)-
Property Insights of Homocysteine, N-acetyl-S-(2-chloroethyl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Homocysteine, N-acetyl-S-(2-chloroethyl)-. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Homocysteine, N-acetyl-S-(2-chloroethyl)-. Following Lipinski's Rule of Five, Homocysteine, N-acetyl-S-(2-chloroethyl)- has 2 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 Homocysteine, N-acetyl-S-(2-chloroethyl)-?
The CAS number of Homocysteine, N-acetyl-S-(2-chloroethyl)- is 36709-10-1.
What is the molecular formula of Homocysteine, N-acetyl-S-(2-chloroethyl)-?
The molecular formula of Homocysteine, N-acetyl-S-(2-chloroethyl)- is C8H14ClNO3S.
What is the molecular weight of Homocysteine, N-acetyl-S-(2-chloroethyl)-?
The molecular weight of Homocysteine, N-acetyl-S-(2-chloroethyl)- is 239.04 g/mol.
Where can I buy Homocysteine, N-acetyl-S-(2-chloroethyl)-?
You can request a quote for Homocysteine, N-acetyl-S-(2-chloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Homocysteine, N-acetyl-S-(2-chloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Homocysteine, N-acetyl-S-(2-chloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.