Antibiotic 6643-X
TL;DR: Antibiotic 6643-X (CAS 82889-90-5) is a chemical compound with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,6E)-3-(2-acetamidoethylsulfanyl)-6-(1-hydroxypropan-2-ylidene)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Also Known As: Antibiotic 6643-X, 6643 X, 6643-X, (5R,6E)-3-(2-acetamidoethylsulfanyl)-6-(1-hydroxypropan-2-ylidene)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((2-(acetylamino)ethyl)thio)-6-(2-hydroxy-1-methylethylidene)-7-oxo-, (R-(E))-
| Molecular Formula | C14H18N2O5S |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 0.0752 |
| Topological Polar Surface Area | 106.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.09363 |
| Heavy Atoms | 22 |
| Complexity | 596.0406 |
Chemical Identifiers
| CAS Number | 82889-90-5 |
|---|---|
| SMILES | C/C(=C\1/[C@H]2CC(=C(N2C1=O)C(=O)O)SCCNC(=O)C)/CO |
Product Overview
Antibiotic 6643-X (CAS 82889-90-5), with molecular formula C14H18N2O5S and molecular weight 326.09 g/mol. IUPAC: (5R,6E)-3-(2-acetamidoethylsulfanyl)-6-(1-hydroxypropan-2-ylidene)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid.
Chemical Property Profile of Antibiotic 6643-X
Property Insights of Antibiotic 6643-X
The XLogP value of 0.0752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antibiotic 6643-X. The TPSA of 106.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Antibiotic 6643-X. Following Lipinski's Rule of Five, Antibiotic 6643-X has 3 hydrogen bond donor(s) and 5 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 Antibiotic 6643-X?
The CAS number of Antibiotic 6643-X is 82889-90-5.
What is the molecular formula of Antibiotic 6643-X?
The molecular formula of Antibiotic 6643-X is C14H18N2O5S.
What is the molecular weight of Antibiotic 6643-X?
The molecular weight of Antibiotic 6643-X is 326.09 g/mol.
Where can I buy Antibiotic 6643-X?
You can request a quote for Antibiotic 6643-X directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antibiotic 6643-X?
Yes, KEHONG BIO provides custom synthesis services for Antibiotic 6643-X and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.