Kufaprim
TL;DR: Kufaprim (CAS 90509-95-8) is a chemical compound with molecular formula C19H24N3O8PS and molecular weight 485.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-[(2-amino-2-phenylacetyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;[(2R,3S)-3-methyloxiran-2-yl]phosphonic acid
Also Known As: Kufaprim, 7-[(2-Amino-1-hydroxy-2-phenylethylidene)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid--(3-methyloxiran-2-yl)phosphonic acid (1/1), (6R,7R)-7-[(2-Amino-1-hydroxy-2-phenylethylidene)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid--[(2R,3S)-3-methyloxiran-2-yl]phosphonic acid (1/1), (6R,7R)-7-[(2-amino-2-phenylacetyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; [(2R,3S)-3-methyloxiran-2-yl]phosphonic acid, (6R,7R)-7-[(2-Amino-2-phenylacetyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;[(2R,3S)-3-methyloxiran-2-yl]phosphonic acid
| Molecular Formula | C19H24N3O8PS |
|---|---|
| Molecular Weight | 485.10 g/mol |
| LogP | 0.3538 |
| Topological Polar Surface Area | 208.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 485.10217 |
| Heavy Atoms | 32 |
| Complexity | 738.0 |
Chemical Identifiers
| CAS Number | 90509-95-8 |
|---|---|
| SMILES | C[C@H]1[C@H](O1)P(=O)(O)O.CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)N)SC1)C(=O)O |
| InChIKey | GIALBPILYZXQBK-XBJQAZQMSA-N |
Product Overview
Kufaprim (CAS 90509-95-8), with molecular formula C19H24N3O8PS and molecular weight 485.10 g/mol. IUPAC: (6R,7R)-7-[(2-amino-2-phenylacetyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;[(2R,3S)-3-methyloxiran-2-yl]phosphonic acid.
Chemical Property Profile of Kufaprim
Property Insights of Kufaprim
The XLogP value of 0.3538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Kufaprim. The TPSA of 208.0 Ų indicates high polarity, suggesting Kufaprim may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Kufaprim has 5 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 Kufaprim?
The CAS number of Kufaprim is 90509-95-8.
What is the molecular formula of Kufaprim?
The molecular formula of Kufaprim is C19H24N3O8PS.
What is the molecular weight of Kufaprim?
The molecular weight of Kufaprim is 485.10 g/mol.
Where can I buy Kufaprim?
You can request a quote for Kufaprim directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kufaprim?
Yes, KEHONG BIO provides custom synthesis services for Kufaprim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.