頭孢氨芐
TL;DR: 頭孢氨芐 (CAS 15686-71-2) is a chemical compound with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
頭孢氨芐
(6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: cephalexin, Cefalexin, Keflex, Cephacillin, Ceporexin
| Molecular Formula | C16H17N3O4S |
|---|---|
| Molecular Weight | 347.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.09396 |
| Heavy Atoms | 24 |
| Complexity | 600.0 |
| Melting Point | 326.8 |
| Boiling Point | 727.4 |
| Solubility | 10mg/mL |
Chemical Identifiers
| CAS Number | 15686-71-2 |
|---|---|
| SMILES | CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N)SC1)C(=O)O |
| InChIKey | ZAIPMKNFIOOWCQ-UEKVPHQBSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
頭孢氨芐 (CAS 15686-71-2), with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol. IUPAC: (6R,7R)-7-[[(2R)-2-amino-2-phenylacetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of 頭孢氨芐
Property Insights of 頭孢氨芐
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 頭孢氨芐. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 頭孢氨芐. Following Lipinski's Rule of Five, 頭孢氨芐 has 3 hydrogen bond donor(s) and 6 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 頭孢氨芐?
The CAS number of 頭孢氨芐 is 15686-71-2.
What is the molecular formula of 頭孢氨芐?
The molecular formula of 頭孢氨芐 is C16H17N3O4S.
What is the molecular weight of 頭孢氨芐?
The molecular weight of 頭孢氨芐 is 347.09 g/mol.
Where can I buy 頭孢氨芐?
You can request a quote for 頭孢氨芐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 頭孢氨芐?
Yes, KEHONG BIO provides custom synthesis services for 頭孢氨芐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.