6-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
6-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0012 |
| Compound Name: | 6-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 438.54 |
| Molecular Formula: | C17 H18 N4 O4 S3 |
| Smiles: | Cc1c(C(N2CCN(CC2)S(c2ccc3c(c2)SC(N3)=O)(=O)=O)=O)sc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3197 |
| logD: | 2.298 |
| logSw: | -3.0015 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.942 |
| InChI Key: | BJWALPDSSNYBPT-UHFFFAOYSA-N |