TL;DR: VU0495440-1 (CAS 1004393-42-3) is a chemical compound with molecular formula C22H17F3N2O3 and molecular weight 414.11914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-acetylphenyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide
Also Known As: VU0495440-1, F2744-1213, N-(4-acetylphenyl)-6-oxo-1-(3-(trifluoromethyl)benzyl)-1,6-dihydropyridine-3-carboxamide, N-(4-acetylphenyl)-6-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]pyridine-3-carboxamide, N-(4-ACETYLPHENYL)-6-OXO-1-{[3-(TRIFLUOROMETHYL)PHENYL]METHYL}-1,6-DIHYDROPYRIDINE-3-CARBOXAMIDE
| Molecular Formula | C22H17F3N2O3 |
| Molecular Weight | 414.11914 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.11914 Da |
| Heavy Atoms | 30 |
| Complexity | 736.0 |
| SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C=C2)CC3=CC(=CC=C3)C(F)(F)F |
| InChIKey | XTVAMKUKXZJQOH-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that VU0495440-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0495440-1. Following Lipinski's Rule of Five, VU0495440-1 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of VU0495440-1 is 1004393-42-3.
The molecular formula of VU0495440-1 is C22H17F3N2O3.
The molecular weight of VU0495440-1 is 414.11914 g/mol.
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