N-[(4-fluorophenyl)methyl]-N~2~-(4-methoxybenzene-1-sulfonyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N~2~-(4-methoxybenzene-1-sulfonyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
N-[(4-fluorophenyl)methyl]-N~2~-(4-methoxybenzene-1-sulfonyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V001-1946 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N~2~-(4-methoxybenzene-1-sulfonyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-[(oxolan-2-yl)methyl]glycinamide |
| Molecular Weight: | 594.66 |
| Molecular Formula: | C31 H31 F N2 O7 S |
| Smiles: | COc1ccc(cc1)S(N(CC1CCCO1)CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5177 |
| logD: | 3.5177 |
| logSw: | -3.9704 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 84.117 |
| InChI Key: | RAUGMGSQHWCFQC-AREMUKBSSA-N |