N-{[4-(dimethylamino)phenyl]methyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C648-0927 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 472.56 |
| Molecular Formula: | C23 H28 N4 O5 S |
| Smiles: | CN(C)c1ccc(CNC(C2CCN(CC2)S(c2ccc3c(c2)OC(N3C)=O)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8589 |
| logD: | 1.8435 |
| logSw: | -2.7466 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.033 |
| InChI Key: | LYGZZZZSKMXLEI-UHFFFAOYSA-N |