3-methyl-6-[4-(thiophene-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-[4-(thiophene-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
3-methyl-6-[4-(thiophene-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0172 |
| Compound Name: | 3-methyl-6-[4-(thiophene-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C17 H17 N3 O4 S3 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccsc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3665 |
| logD: | 2.3665 |
| logSw: | -2.8384 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.034 |
| InChI Key: | AXFPWSZCVFGRKH-UHFFFAOYSA-N |