N-butyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)nonanamide
Chemical Structure Depiction of
N-butyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)nonanamide
N-butyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)nonanamide
Compound characteristics
| Compound ID: | V015-8896 |
| Compound Name: | N-butyl-N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)nonanamide |
| Molecular Weight: | 536.69 |
| Molecular Formula: | C32 H41 F N2 O4 |
| Smiles: | CCCCCCCCC(N(CCCC)CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6685 |
| logD: | 6.6685 |
| logSw: | -5.7039 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.749 |
| InChI Key: | NZNTYAAYFZJHON-UHFFFAOYSA-N |