Flucexin
TL;DR: Flucexin (CAS 79806-18-1) is a chemical compound with molecular formula C35H34ClFN6O9S2 and molecular weight 800.15 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;(2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Flucexin, Cephalexin / Floxacillin, Cephalexin mixture with Floxacillin, (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; (2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic 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;(2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
| Molecular Formula | C35H34ClFN6O9S2 |
|---|---|
| Molecular Weight | 800.15 g/mol |
| LogP | 3.13272 |
| Topological Polar Surface Area | 276.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 800.15015 |
| Heavy Atoms | 54 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 79806-18-1 |
|---|---|
| SMILES | CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)N)SC1)C(=O)O.CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O |
| InChIKey | OWXZKSOCHOSWJC-FJBOHYJFSA-N |
Product Overview
Flucexin (CAS 79806-18-1), with molecular formula C35H34ClFN6O9S2 and molecular weight 800.15 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;(2S,5R,6R)-6-[[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
Chemical Property Profile of Flucexin
Property Insights of Flucexin
The XLogP value of 3.13272 indicates that Flucexin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 276.0 Ų indicates high polarity, suggesting Flucexin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Flucexin has 5 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Flucexin?
The CAS number of Flucexin is 79806-18-1.
What is the molecular formula of Flucexin?
The molecular formula of Flucexin is C35H34ClFN6O9S2.
What is the molecular weight of Flucexin?
The molecular weight of Flucexin is 800.15 g/mol.
Where can I buy Flucexin?
You can request a quote for Flucexin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Flucexin?
Yes, KEHONG BIO provides custom synthesis services for Flucexin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.