BAS 11132106
TL;DR: BAS 11132106 (CAS 727392-07-6) is a chemical compound with molecular formula C16H14ClFN2O3 and molecular weight 336.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-2,5-dioxo-1,3,4,6,7,8-hexahydroquinoline-4-carboxamide
Also Known As: BAS 11132106, N-(3-chloro-4-fluorophenyl)-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-4-carboxamide, (2,5-dioxo(4-1,3,4,6,7,8-hexahydroquinolyl))-N-(3-chloro-4-fluorophenyl)carbox amide, N-(3-chloro-4-fluorophenyl)-2,5-dioxo-1,3,4,6,7,8-hexahydroquinoline-4-carboxamide, N-(3-chloro-4-fluorophenyl)-2-hydroxy-5-oxo-3,4,5,6,7,8-hexahydroquinoline-4-carboxamide
| Molecular Formula | C16H14ClFN2O3 |
|---|---|
| Molecular Weight | 336.07 g/mol |
| LogP | 2.5608 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.0677 |
| Heavy Atoms | 23 |
| Complexity | 744.84094 |
Chemical Identifiers
| CAS Number | 727392-07-6 |
|---|---|
| SMILES | C1CC2=C(C(CC(=O)N2)C(=O)NC3=CC(=C(C=C3)F)Cl)C(=O)C1 |
Product Overview
BAS 11132106 (CAS 727392-07-6), with molecular formula C16H14ClFN2O3 and molecular weight 336.07 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-2,5-dioxo-1,3,4,6,7,8-hexahydroquinoline-4-carboxamide.
Chemical Property Profile of BAS 11132106
Property Insights of BAS 11132106
The XLogP value of 2.5608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 11132106. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11132106. Following Lipinski's Rule of Five, BAS 11132106 has 2 hydrogen bond donor(s) and 3 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 11132106?
The CAS number of BAS 11132106 is 727392-07-6.
What is the molecular formula of BAS 11132106?
The molecular formula of BAS 11132106 is C16H14ClFN2O3.
What is the molecular weight of BAS 11132106?
The molecular weight of BAS 11132106 is 336.07 g/mol.
Where can I buy BAS 11132106?
You can request a quote for BAS 11132106 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11132106?
Yes, KEHONG BIO provides custom synthesis services for BAS 11132106 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.