N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C648-0269 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 514.64 |
| Molecular Formula: | C26 H34 N4 O5 S |
| Smiles: | CCN(CCCNC(C1CCCN(C1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O)c1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.074 |
| logD: | 3.0418 |
| logSw: | -3.596 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.993 |
| InChI Key: | VHJDBWKBOFGRDI-FQEVSTJZSA-N |