6-[4-(2-methylbenzoyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(2-methylbenzoyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
6-[4-(2-methylbenzoyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0673 |
| Compound Name: | 6-[4-(2-methylbenzoyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C22 H25 N3 O4 S2 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccccc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8508 |
| logD: | 3.8508 |
| logSw: | -3.904 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.228 |
| InChI Key: | SSPMKFVZZVLYQL-UHFFFAOYSA-N |