3-ethyl-6-[4-(4-methylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-ethyl-6-[4-(4-methylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
3-ethyl-6-[4-(4-methylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L306-0898 |
| Compound Name: | 3-ethyl-6-[4-(4-methylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 452.59 |
| Molecular Formula: | C20 H28 N4 O4 S2 |
| Smiles: | CCN1C(=O)Sc2cc(ccc12)S(N1CCC(CC1)C(N1CCN(C)CC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9725 |
| logD: | 1.6245 |
| logSw: | -2.7261 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 67.644 |
| InChI Key: | OBPPRMLVYKTSAK-UHFFFAOYSA-N |