N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide
N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide
Compound characteristics
| Compound ID: | C597-0245 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)phenylalaninamide |
| Molecular Weight: | 506.62 |
| Molecular Formula: | C27 H30 N4 O4 S |
| Smiles: | CN(C)c1ccc(CNC(C(Cc2ccccc2)NS(c2ccc3c(CCC(N3)=O)c2)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8165 |
| logD: | 2.7997 |
| logSw: | -3.6023 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.879 |
| InChI Key: | VUSOUMLFADCGLC-VWLOTQADSA-N |