6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | G305-1291 |
| Compound Name: | 6-{3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]piperidine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C25 H30 N4 O5 S |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C(C1CCCN(C1)S(c1ccc2c(c1)OC(N2)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3041 |
| logD: | 3.2704 |
| logSw: | -3.8895 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.908 |
| InChI Key: | HRBISBCLQZJXRZ-IBGZPJMESA-N |