ChemDiv1_014600
TL;DR: ChemDiv1_014600 (CAS 317329-46-7) is a chemical compound with molecular formula C15H16N2O6S and molecular weight 352.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-hydroxypiperidin-1-yl)sulfonyl-4-oxo-1H-quinoline-3-carboxylic acid
Also Known As: ChemDiv1_014600, 6-[(4-Hydroxypiperidin-1-yl)sulfonyl]-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, 6-(4-hydroxypiperidin-1-yl)sulfonyl-4-oxo-1H-quinoline-3-carboxylic acid, 3-quinolinecarboxylic acid, 1,4-dihydro-6-[(4-hydroxy-1-piperidinyl)sulfonyl]-4-oxo-, 6-((4-Hydroxypiperidin-1-yl)sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
| Molecular Formula | C15H16N2O6S |
|---|---|
| Molecular Weight | 352.07 g/mol |
| LogP | 0.3717 |
| Topological Polar Surface Area | 127.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.0729 |
| Heavy Atoms | 24 |
| Complexity | 957.57837 |
Chemical Identifiers
| CAS Number | 317329-46-7 |
|---|---|
| SMILES | C1CN(CCC1O)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)O |
Product Overview
ChemDiv1_014600 (CAS 317329-46-7), with molecular formula C15H16N2O6S and molecular weight 352.07 g/mol. IUPAC: 6-(4-hydroxypiperidin-1-yl)sulfonyl-4-oxo-1H-quinoline-3-carboxylic acid.
Chemical Property Profile of ChemDiv1_014600
Property Insights of ChemDiv1_014600
The XLogP value of 0.3717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_014600. The TPSA of 127.77 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014600. Following Lipinski's Rule of Five, ChemDiv1_014600 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 ChemDiv1_014600?
The CAS number of ChemDiv1_014600 is 317329-46-7.
What is the molecular formula of ChemDiv1_014600?
The molecular formula of ChemDiv1_014600 is C15H16N2O6S.
What is the molecular weight of ChemDiv1_014600?
The molecular weight of ChemDiv1_014600 is 352.07 g/mol.
Where can I buy ChemDiv1_014600?
You can request a quote for ChemDiv1_014600 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014600?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014600 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.