头孢吡肟
TL;DR: 头孢吡肟 (CAS 88040-23-7) is a chemical compound with molecular formula C19H24N6O5S2 and molecular weight 480.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
头孢吡肟
7-[[2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(1-methylpyrrolidin-1-ium-1-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: cefepime, Cefepima, Cefepimum, Maxipime, Axepim
| Molecular Formula | C19H24N6O5S2 |
|---|---|
| Molecular Weight | 480.12 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 204.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.12497 |
| Heavy Atoms | 32 |
| Complexity | 869.0 |
Chemical Identifiers
| CAS Number | 88040-23-7 |
|---|---|
| SMILES | C[N+]1(CCCC1)CC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)[O-] |
| InChIKey | HVFLCNVBZFFHBT-UHFFFAOYSA-N |
Product Overview
头孢吡肟 (CAS 88040-23-7), with molecular formula C19H24N6O5S2 and molecular weight 480.12 g/mol. IUPAC: 7-[[2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(1-methylpyrrolidin-1-ium-1-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate.
Chemical Property Profile of 头孢吡肟
Property Insights of 头孢吡肟
The XLogP value of -0.1 indicates that 头孢吡肟 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 204.0 Ų indicates high polarity, suggesting 头孢吡肟 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 头孢吡肟 has 2 hydrogen bond donor(s) and 10 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 头孢吡肟?
The CAS number of 头孢吡肟 is 88040-23-7.
What is the molecular formula of 头孢吡肟?
The molecular formula of 头孢吡肟 is C19H24N6O5S2.
What is the molecular weight of 头孢吡肟?
The molecular weight of 头孢吡肟 is 480.12 g/mol.
Where can I buy 头孢吡肟?
You can request a quote for 头孢吡肟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 头孢吡肟?
Yes, KEHONG BIO provides custom synthesis services for 头孢吡肟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.