N-(4-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazine-1-sulfonyl}-2-chlorophenyl)acetamide
Chemical Structure Depiction of
N-(4-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazine-1-sulfonyl}-2-chlorophenyl)acetamide
N-(4-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazine-1-sulfonyl}-2-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | V008-4383 |
| Compound Name: | N-(4-{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazine-1-sulfonyl}-2-chlorophenyl)acetamide |
| Molecular Weight: | 515.97 |
| Molecular Formula: | C23 H22 Cl N5 O5 S |
| Salt: | not_available |
| Smiles: | CC(Nc1ccc(cc1[Cl])S(N1CCN(CC1)c1nccc(c2ccc3c(c2)OCO3)n1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2456 |
| logD: | 3.2195 |
| logSw: | -3.6519 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.548 |
| InChI Key: | WZPUXQSGYUDJAZ-UHFFFAOYSA-N |