N-[(4-methylphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
N-[(4-methylphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G305-0876 |
| Compound Name: | N-[(4-methylphenyl)methyl]-1-(2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 429.49 |
| Molecular Formula: | C21 H23 N3 O5 S |
| Smiles: | Cc1ccc(CNC(C2CCN(CC2)S(c2ccc3c(c2)OC(N3)=O)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1932 |
| logD: | 2.1596 |
| logSw: | -2.8646 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.78 |
| InChI Key: | AATKXECWDVEOHS-UHFFFAOYSA-N |