N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-4-methylbenzamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-4-methylbenzamide
N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-4-methylbenzamide
Compound characteristics
| Compound ID: | V001-1934 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-4-methylbenzamide |
| Molecular Weight: | 516.57 |
| Molecular Formula: | C30 H29 F N2 O5 |
| Smiles: | Cc1ccc(cc1)C(N(CCOC)CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5386 |
| logD: | 3.5386 |
| logSw: | -3.6875 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.347 |
| InChI Key: | JIEQQTIJZHGLPQ-UHFFFAOYSA-N |