Viccillin S (combination)
TL;DR: Viccillin S (combination) (CAS 4219-54-9) is a chemical compound with molecular formula C35H37ClN6O9S2 and molecular weight 784.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,5R,6R)-6-[(2-amino-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;(2S,5R,6R)-6-[[3-(2-chlorophenyl)-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: Ampiclox, Viccillin S, Viccillin S (combination), Ampicillin mixture with cloxacillin, KST-1A4776
| Molecular Formula | C35H37ClN6O9S2 |
|---|---|
| Molecular Weight | 784.18 g/mol |
| LogP | 2.86682 |
| Topological Polar Surface Area | 276.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 784.1752 |
| Heavy Atoms | 53 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 4219-54-9 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)O.CC1([C@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)N)C(=O)O)C |
| InChIKey | QHQUZKWKSZIMPO-VFCPWSTESA-N |
Product Overview
Viccillin S (combination) (CAS 4219-54-9), with molecular formula C35H37ClN6O9S2 and molecular weight 784.18 g/mol. IUPAC: (2R,5R,6R)-6-[(2-amino-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid;(2S,5R,6R)-6-[[3-(2-chlorophenyl)-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 Viccillin S (combination)
Property Insights of Viccillin S (combination)
The XLogP value of 2.86682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Viccillin S (combination). The TPSA of 276.0 Ų indicates high polarity, suggesting Viccillin S (combination) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Viccillin S (combination) has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Viccillin S (combination)?
The CAS number of Viccillin S (combination) is 4219-54-9.
What is the molecular formula of Viccillin S (combination)?
The molecular formula of Viccillin S (combination) is C35H37ClN6O9S2.
What is the molecular weight of Viccillin S (combination)?
The molecular weight of Viccillin S (combination) is 784.18 g/mol.
Where can I buy Viccillin S (combination)?
You can request a quote for Viccillin S (combination) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Viccillin S (combination)?
Yes, KEHONG BIO provides custom synthesis services for Viccillin S (combination) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.