N-[(4-fluorophenyl)methyl]-N~2~-(3-methylbutyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(quinoline-8-sulfonyl)glycinamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N~2~-(3-methylbutyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(quinoline-8-sulfonyl)glycinamide
N-[(4-fluorophenyl)methyl]-N~2~-(3-methylbutyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(quinoline-8-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | V002-0438 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N~2~-(3-methylbutyl)-N-[(4-oxo-4H-1-benzopyran-3-yl)methyl]-N~2~-(quinoline-8-sulfonyl)glycinamide |
| Molecular Weight: | 601.7 |
| Molecular Formula: | C33 H32 F N3 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)CCN(CC(N(CC1=COc2ccccc2C1=O)Cc1ccc(cc1)F)=O)S(c1cccc2cccnc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.813 |
| logD: | 4.813 |
| logSw: | -4.7188 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 77.702 |
| InChI Key: | MWTBMNHRFQNAJO-UHFFFAOYSA-N |