3-methyl-6-[4-(4-methylbenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-[4-(4-methylbenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
3-methyl-6-[4-(4-methylbenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0223 |
| Compound Name: | 3-methyl-6-[4-(4-methylbenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C20 H21 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)C(N1CCN(CC1)S(c1ccc2c(c1)SC(N2C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9754 |
| logD: | 2.9754 |
| logSw: | -3.4399 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.016 |
| InChI Key: | RIEZANSFGFGSML-UHFFFAOYSA-N |