阿西维辛
TL;DR: 阿西维辛 (CAS 76898-56-1) is a chemical compound with molecular formula C5H7ClN2O3 and molecular weight 178.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
阿西维辛
(2S)-2-amino-2-[(5S)-3-chloro-4,5-dihydro-1,2-oxazol-5-yl]acetic acid
Also Known As: acivicin, Acivicine, Antibiotic AT 125, Acivicinum, Acivicino
| Molecular Formula | C5H7ClN2O3 |
|---|---|
| Molecular Weight | 178.01 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.01453 |
| Heavy Atoms | 11 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 76898-56-1 |
|---|---|
| SMILES | C1[C@H](ON=C1Cl)[C@@H](C(=O)O)N |
| InChIKey | QAWIHIJWNYOLBE-OKKQSCSOSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
阿西维辛 (CAS 76898-56-1), with molecular formula C5H7ClN2O3 and molecular weight 178.01 g/mol. IUPAC: (2S)-2-amino-2-[(5S)-3-chloro-4,5-dihydro-1,2-oxazol-5-yl]acetic acid.
Chemical Property Profile of 阿西维辛
Property Insights of 阿西维辛
The XLogP value of -2.7 indicates that 阿西维辛 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 阿西维辛. Following Lipinski's Rule of Five, 阿西维辛 has 2 hydrogen bond donor(s) and 5 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 阿西维辛?
The CAS number of 阿西维辛 is 76898-56-1.
What is the molecular formula of 阿西维辛?
The molecular formula of 阿西维辛 is C5H7ClN2O3.
What is the molecular weight of 阿西维辛?
The molecular weight of 阿西维辛 is 178.01 g/mol.
Where can I buy 阿西维辛?
You can request a quote for 阿西维辛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 阿西维辛?
Yes, KEHONG BIO provides custom synthesis services for 阿西维辛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.