TL;DR: Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl- (CAS 130421-35-1) is a chemical compound with molecular formula C15H12N2O3 and molecular weight 268.08478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dioxo-4-phenyl-N-pyridin-2-ylbutanamide
Also Known As: Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl-, alpha,gamma-Dioxo-N-2-pyridinylbenzenebutanamide, 2,4-dioxo-4-phenyl-N-pyridin-2-ylbutanamide, 2,4-DIOXO-4-PHENYL-N-(PYRIDIN-2-YL)BUTANAMIDE, BRN 4751541
| Molecular Formula | C15H12N2O3 |
| Molecular Weight | 268.08478 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 268.08478 Da |
| Heavy Atoms | 20 |
| Complexity | 375.0 |
| SMILES | C1=CC=C(C=C1)C(=O)CC(=O)C(=O)NC2=CC=CC=N2 |
| InChIKey | SNPZWZTYJYKVTG-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl-. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl-. Following Lipinski's Rule of Five, Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl- is 130421-35-1.
The molecular formula of Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl- is C15H12N2O3.
The molecular weight of Benzenebutanamide, alpha,gamma-dioxo-N-2-pyridinyl- is 268.08478 g/mol.
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