6-[4-(4-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(4-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
6-[4-(4-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0227 |
| Compound Name: | 6-[4-(4-methoxybenzoyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C20 H21 N3 O5 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5344 |
| logD: | 2.5344 |
| logSw: | -2.9424 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.56 |
| InChI Key: | AXLQVXPSOZSYAF-UHFFFAOYSA-N |