4-ethyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
4-ethyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
4-ethyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V001-5551 |
| Compound Name: | 4-ethyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 530.6 |
| Molecular Formula: | C31 H31 F N2 O5 |
| Smiles: | CCc1ccc(cc1)C(N(CCOC)CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0458 |
| logD: | 4.0458 |
| logSw: | -4.14 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.347 |
| InChI Key: | GYQVNFZSRJQZKT-UHFFFAOYSA-N |