S-(2-氯乙基)-L-半胱氨酸甲酯
TL;DR: S-(2-氯乙基)-L-半胱氨酸甲酯 (CAS 88169-60-2) is a chemical compound with molecular formula C6H12ClNO2S and molecular weight 197.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-氯乙基)-L-半胱氨酸甲酯
methyl (2R)-2-amino-3-(2-chloroethylsulfanyl)propanoate
Also Known As: S-(2-Chloroethyl)-L-cysteine, methyl ester, S-(2-Chloroethyl)-L-cysteine methyl ester, Methyl S-(2-chloroethyl)-L-cysteinate, L-Cysteine, S-(2-chloroethyl)-, methyl ester, methyl (2R)-2-amino-3-(2-chloroethylsulfanyl)propanoate
| Molecular Formula | C6H12ClNO2S |
|---|---|
| Molecular Weight | 197.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 197.02773 |
| Heavy Atoms | 11 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 88169-60-2 |
|---|---|
| SMILES | COC(=O)[C@H](CSCCCl)N |
| InChIKey | HWPQRXJHBCRFLG-YFKPBYRVSA-N |
Product Overview
S-(2-氯乙基)-L-半胱氨酸甲酯 (CAS 88169-60-2), with molecular formula C6H12ClNO2S and molecular weight 197.03 g/mol. IUPAC: methyl (2R)-2-amino-3-(2-chloroethylsulfanyl)propanoate.
Chemical Property Profile of S-(2-氯乙基)-L-半胱氨酸甲酯
Property Insights of S-(2-氯乙基)-L-半胱氨酸甲酯
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-氯乙基)-L-半胱氨酸甲酯. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-氯乙基)-L-半胱氨酸甲酯. Following Lipinski's Rule of Five, S-(2-氯乙基)-L-半胱氨酸甲酯 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 S-(2-氯乙基)-L-半胱氨酸甲酯?
The CAS number of S-(2-氯乙基)-L-半胱氨酸甲酯 is 88169-60-2.
What is the molecular formula of S-(2-氯乙基)-L-半胱氨酸甲酯?
The molecular formula of S-(2-氯乙基)-L-半胱氨酸甲酯 is C6H12ClNO2S.
What is the molecular weight of S-(2-氯乙基)-L-半胱氨酸甲酯?
The molecular weight of S-(2-氯乙基)-L-半胱氨酸甲酯 is 197.03 g/mol.
Where can I buy S-(2-氯乙基)-L-半胱氨酸甲酯?
You can request a quote for S-(2-氯乙基)-L-半胱氨酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-氯乙基)-L-半胱氨酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for S-(2-氯乙基)-L-半胱氨酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.