N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide
Compound characteristics
| Compound ID: | C562-1590 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-Nalpha-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)phenylalaninamide |
| Molecular Weight: | 508.6 |
| Molecular Formula: | C26 H28 N4 O5 S |
| Smiles: | CN(C)c1ccc(CNC(C(Cc2ccccc2)NS(c2ccc3c(c2)OC(N3C)=O)(=O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9002 |
| logD: | 2.8845 |
| logSw: | -3.6515 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.924 |
| InChI Key: | VZPKCOHXMKJYQN-QFIPXVFZSA-N |