6-[4-(4-chloro-2-methoxybenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(4-chloro-2-methoxybenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
6-[4-(4-chloro-2-methoxybenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0112 |
| Compound Name: | 6-[4-(4-chloro-2-methoxybenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 467.95 |
| Molecular Formula: | C19 H18 Cl N3 O5 S2 |
| Smiles: | COc1cc(ccc1C(N1CCN(CC1)S(c1ccc2c(c1)SC(N2)=O)(=O)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2907 |
| logD: | 3.269 |
| logSw: | -3.7762 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.184 |
| InChI Key: | RNWBQGHSYJQTFM-UHFFFAOYSA-N |