丙匹西林
TL;DR: 丙匹西林 (CAS 551-27-9) is a chemical compound with molecular formula C18H22N2O5S and molecular weight 378.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丙匹西林
3,3-dimethyl-7-oxo-6-(2-phenoxybutanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Propicillin, propicilline, Propicillinum, Propicilina, levopropicillin
| Molecular Formula | C18H22N2O5S |
|---|---|
| Molecular Weight | 378.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.12494 |
| Heavy Atoms | 26 |
| Complexity | 590.0 |
Chemical Identifiers
| CAS Number | 551-27-9 |
|---|---|
| SMILES | CCC(C(=O)NC1C2N(C1=O)C(C(S2)(C)C)C(=O)O)OC3=CC=CC=C3 |
| InChIKey | HOCWPKXKMNXINF-UHFFFAOYSA-N |
Product Overview
丙匹西林 (CAS 551-27-9), with molecular formula C18H22N2O5S and molecular weight 378.12 g/mol. IUPAC: 3,3-dimethyl-7-oxo-6-(2-phenoxybutanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of 丙匹西林
Property Insights of 丙匹西林
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丙匹西林. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 丙匹西林. Following Lipinski's Rule of Five, 丙匹西林 has 2 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 丙匹西林?
The CAS number of 丙匹西林 is 551-27-9.
What is the molecular formula of 丙匹西林?
The molecular formula of 丙匹西林 is C18H22N2O5S.
What is the molecular weight of 丙匹西林?
The molecular weight of 丙匹西林 is 378.12 g/mol.
Where can I buy 丙匹西林?
You can request a quote for 丙匹西林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丙匹西林?
Yes, KEHONG BIO provides custom synthesis services for 丙匹西林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.