N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-hexyl-N-(3-methoxypropyl)benzamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-hexyl-N-(3-methoxypropyl)benzamide
N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-hexyl-N-(3-methoxypropyl)benzamide
Compound characteristics
| Compound ID: | V001-9169 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)-4-hexyl-N-(3-methoxypropyl)benzamide |
| Molecular Weight: | 600.73 |
| Molecular Formula: | C36 H41 F N2 O5 |
| Smiles: | CCCCCCc1ccc(cc1)C(N(CCCOC)CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.475 |
| logD: | 6.475 |
| logSw: | -5.6353 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.347 |
| InChI Key: | HPCGWIMVABFYFQ-UHFFFAOYSA-N |