BAS 04449045
TL;DR: BAS 04449045 (CAS 23681-34-7) is a chemical compound with molecular formula C18H16ClN3O2 and molecular weight 341.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide
Also Known As: BAS 04449045, N-(3-chlorophenyl)-1-ethyl-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide, N-(3-chlorophenyl)-1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide, N-(3-chlorophenyl)(1-ethyl-7-methyl-4-oxohydropyridino[2,3-b]pyridin-3-yl)carb oxamide
| Molecular Formula | C18H16ClN3O2 |
|---|---|
| Molecular Weight | 341.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.0931 |
| Heavy Atoms | 24 |
| Complexity | 536.0 |
Chemical Identifiers
| CAS Number | 23681-34-7 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C(=O)NC3=CC(=CC=C3)Cl |
| InChIKey | PKHOVIYKNJREES-UHFFFAOYSA-N |
Product Overview
BAS 04449045 (CAS 23681-34-7), with molecular formula C18H16ClN3O2 and molecular weight 341.09 g/mol. IUPAC: N-(3-chlorophenyl)-1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide.
Chemical Property Profile of BAS 04449045
Property Insights of BAS 04449045
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04449045. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04449045. Following Lipinski's Rule of Five, BAS 04449045 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 BAS 04449045?
The CAS number of BAS 04449045 is 23681-34-7.
What is the molecular formula of BAS 04449045?
The molecular formula of BAS 04449045 is C18H16ClN3O2.
What is the molecular weight of BAS 04449045?
The molecular weight of BAS 04449045 is 341.09 g/mol.
Where can I buy BAS 04449045?
You can request a quote for BAS 04449045 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04449045?
Yes, KEHONG BIO provides custom synthesis services for BAS 04449045 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.