1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide
TL;DR: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide (CAS 310447-04-2) is a chemical compound with molecular formula C23H26FN5O2 and molecular weight 423.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide
Also Known As: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide, 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide
| Molecular Formula | C23H26FN5O2 |
|---|---|
| Molecular Weight | 423.21 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.20706 |
| Heavy Atoms | 31 |
| Complexity | 693.0 |
Chemical Identifiers
| CAS Number | 310447-04-2 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C)F)C(=O)NCC4=CC=CC=N4 |
| InChIKey | SPJCQIMUXBEAQD-UHFFFAOYSA-N |
Product Overview
1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide (CAS 310447-04-2), with molecular formula C23H26FN5O2 and molecular weight 423.21 g/mol. IUPAC: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide.
Chemical Property Profile of 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide
Property Insights of 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide. Following Lipinski's Rule of Five, 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide has 1 hydrogen bond donor(s) and 7 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 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide?
The CAS number of 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide is 310447-04-2.
What is the molecular formula of 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide?
The molecular formula of 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide is C23H26FN5O2.
What is the molecular weight of 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide?
The molecular weight of 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide is 423.21 g/mol.
Where can I buy 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide?
You can request a quote for 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.