N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)dodecanamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)dodecanamide
N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)dodecanamide
Compound characteristics
| Compound ID: | V001-5563 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)dodecanamide |
| Molecular Weight: | 580.74 |
| Molecular Formula: | C34 H45 F N2 O5 |
| Smiles: | CCCCCCCCCCCC(N(CCOC)CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7466 |
| logD: | 6.7466 |
| logSw: | -5.7081 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.091 |
| InChI Key: | BPTACCUVPZYGAU-UHFFFAOYSA-N |