N-[(4-fluorophenyl)methyl]-N~2~-[(3-methylphenyl)carbamoyl]-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N~2~-[(3-methylphenyl)carbamoyl]-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide
N-[(4-fluorophenyl)methyl]-N~2~-[(3-methylphenyl)carbamoyl]-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide
Compound characteristics
| Compound ID: | V002-3791 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N~2~-[(3-methylphenyl)carbamoyl]-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(prop-2-en-1-yl)glycinamide |
| Molecular Weight: | 513.57 |
| Molecular Formula: | C30 H28 F N3 O4 |
| Smiles: | Cc1cccc(c1)NC(N(CC=C)CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5043 |
| logD: | 4.5043 |
| logSw: | -4.4249 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.826 |
| InChI Key: | SMJAVQGZVGOXSI-UHFFFAOYSA-N |