N-[(2-chlorophenyl)methyl]-1-{5-[2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-1-{5-[2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-3-carboxamide
N-[(2-chlorophenyl)methyl]-1-{5-[2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C697-0300 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-1-{5-[2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-3-carboxamide |
| Molecular Weight: | 466.99 |
| Molecular Formula: | C21 H27 Cl N4 O4 S |
| Smiles: | Cc1c(c(/C=C/N(C)C)on1)S(N1CCCC(C1)C(NCc1ccccc1[Cl])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5318 |
| logD: | 1.5312 |
| logSw: | -2.6639 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.582 |
| InChI Key: | ZPHJYVLFROQKQK-KRWDZBQOSA-N |