6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | C648-0100 |
| Compound Name: | 6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C26 H32 N4 O5 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(C1CCCN(C1)S(c1ccc2c(c1)OC(N2C)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3032 |
| logD: | 3.3032 |
| logSw: | -3.8736 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.356 |
| InChI Key: | SQOHGTWMMXTWKQ-FQEVSTJZSA-N |