BAS 11216093
TL;DR: BAS 11216093 (CAS 774562-75-3) is a chemical compound with molecular formula C19H21FN2O3 and molecular weight 344.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]-7,7-dimethyl-2,5-dioxo-3,4,6,8-tetrahydro-1H-quinoline-4-carboxamide
Also Known As: BAS 11216093, N-(4-fluorobenzyl)-7,7-dimethyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-4-carboxamide, (7,7-dimethyl-2,5-dioxo(4-1,3,4,6,7,8-hexahydroquinolyl))-N-[(4-fluorophenyl)m ethyl]carboxamide, N-(4-fluorobenzyl)-5-hydroxy-7,7-dimethyl-2-oxo-2,3,4,6,7,8-hexahydroquinoline-4-carboxamide, N-[(4-fluorophenyl)methyl]-7,7-dimethyl-2,5-dioxo-3,4,6,8-tetrahydro-1H-quinoline-4-carboxamide
| Molecular Formula | C19H21FN2O3 |
|---|---|
| Molecular Weight | 344.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.15363 |
| Heavy Atoms | 25 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 774562-75-3 |
|---|---|
| SMILES | CC1(CC2=C(C(CC(=O)N2)C(=O)NCC3=CC=C(C=C3)F)C(=O)C1)C |
| InChIKey | JPBQVXRJKPBQTD-UHFFFAOYSA-N |
Product Overview
BAS 11216093 (CAS 774562-75-3), with molecular formula C19H21FN2O3 and molecular weight 344.15 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]-7,7-dimethyl-2,5-dioxo-3,4,6,8-tetrahydro-1H-quinoline-4-carboxamide.
Chemical Property Profile of BAS 11216093
Property Insights of BAS 11216093
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 11216093. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11216093. Following Lipinski's Rule of Five, BAS 11216093 has 2 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 11216093?
The CAS number of BAS 11216093 is 774562-75-3.
What is the molecular formula of BAS 11216093?
The molecular formula of BAS 11216093 is C19H21FN2O3.
What is the molecular weight of BAS 11216093?
The molecular weight of BAS 11216093 is 344.15 g/mol.
Where can I buy BAS 11216093?
You can request a quote for BAS 11216093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11216093?
Yes, KEHONG BIO provides custom synthesis services for BAS 11216093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.