N-(4-bromo-3-methylphenyl)-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
N-(4-bromo-3-methylphenyl)-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C648-0010 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-1-(3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 508.39 |
| Molecular Formula: | C21 H22 Br N3 O5 S |
| Smiles: | Cc1cc(ccc1[Br])NC(C1CCCN(C1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.171 |
| logD: | 3.1694 |
| logSw: | -3.6174 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.84 |
| InChI Key: | KUSUKRROVHCHKC-AWEZNQCLSA-N |