ChemDiv3_012746
TL;DR: ChemDiv3_012746 (CAS 897769-45-8) is a chemical compound with molecular formula C19H24N2O5S and molecular weight 392.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxoquinoline-3-carboxylic acid
Also Known As: ChemDiv3_012746, BRD-K76466445-001-01-8, 6-[(Cyclohexylmethylamino)sulfonyl]-1-ethyl-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid, 6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxoquinoline-3-carboxylic acid, 6-[Cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
| Molecular Formula | C19H24N2O5S |
|---|---|
| Molecular Weight | 392.14 g/mol |
| LogP | 2.6728 |
| Topological Polar Surface Area | 96.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.1406 |
| Heavy Atoms | 27 |
| Complexity | 1035.9814 |
Chemical Identifiers
| CAS Number | 897769-45-8 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N(C)C3CCCCC3)C(=O)O |
Product Overview
ChemDiv3_012746 (CAS 897769-45-8), with molecular formula C19H24N2O5S and molecular weight 392.14 g/mol. IUPAC: 6-[cyclohexyl(methyl)sulfamoyl]-1-ethyl-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of ChemDiv3_012746
Property Insights of ChemDiv3_012746
The XLogP value of 2.6728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_012746. The TPSA of 96.68 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_012746. Following Lipinski's Rule of Five, ChemDiv3_012746 has 1 hydrogen bond donor(s) and 4 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 ChemDiv3_012746?
The CAS number of ChemDiv3_012746 is 897769-45-8.
What is the molecular formula of ChemDiv3_012746?
The molecular formula of ChemDiv3_012746 is C19H24N2O5S.
What is the molecular weight of ChemDiv3_012746?
The molecular weight of ChemDiv3_012746 is 392.14 g/mol.
Where can I buy ChemDiv3_012746?
You can request a quote for ChemDiv3_012746 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_012746?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_012746 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.