N-{3-[benzyl(methyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
N-{3-[benzyl(methyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C648-0268 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 500.62 |
| Molecular Formula: | C25 H32 N4 O5 S |
| Smiles: | CN(CCCNC(C1CCCN(C1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8165 |
| logD: | 0.3192 |
| logSw: | -2.7232 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.098 |
| InChI Key: | ZJXLWMDLPSYETD-FQEVSTJZSA-N |