6-{4-[(4-chlorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[(4-chlorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one
6-{4-[(4-chlorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0234 |
| Compound Name: | 6-{4-[(4-chlorophenyl)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 465.98 |
| Molecular Formula: | C20 H20 Cl N3 O4 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(Cc1ccc(cc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4261 |
| logD: | 3.4261 |
| logSw: | -3.8569 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.488 |
| InChI Key: | XSVQGMSDCNSTQL-UHFFFAOYSA-N |