ChemDiv3_013695
TL;DR: ChemDiv3_013695 (CAS 6210-71-5) is a chemical compound with molecular formula C19H15ClN2O4S and molecular weight 402.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfonyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid
Also Known As: ChemDiv3_013695, IDI1_029845, BRD-K54715618-001-01-5, 2-(4-chlorophenyl)sulfonyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid, 2-(4-Chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridine-10-carboxylic acid
| Molecular Formula | C19H15ClN2O4S |
|---|---|
| Molecular Weight | 402.04 g/mol |
| LogP | 3.3334 |
| Topological Polar Surface Area | 87.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.0441 |
| Heavy Atoms | 27 |
| Complexity | 1160.2932 |
Chemical Identifiers
| CAS Number | 6210-71-5 |
|---|---|
| SMILES | C1CN(CC2=C(C3=CC=CC=C3N=C21)C(=O)O)S(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
ChemDiv3_013695 (CAS 6210-71-5), with molecular formula C19H15ClN2O4S and molecular weight 402.04 g/mol. IUPAC: 2-(4-chlorophenyl)sulfonyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid.
Chemical Property Profile of ChemDiv3_013695
Property Insights of ChemDiv3_013695
The XLogP value of 3.3334 indicates that ChemDiv3_013695 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.57 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_013695. Following Lipinski's Rule of Five, ChemDiv3_013695 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_013695?
The CAS number of ChemDiv3_013695 is 6210-71-5.
What is the molecular formula of ChemDiv3_013695?
The molecular formula of ChemDiv3_013695 is C19H15ClN2O4S.
What is the molecular weight of ChemDiv3_013695?
The molecular weight of ChemDiv3_013695 is 402.04 g/mol.
Where can I buy ChemDiv3_013695?
You can request a quote for ChemDiv3_013695 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_013695?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_013695 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.