6-[4-(5-bromopyridine-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(5-bromopyridine-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
6-[4-(5-bromopyridine-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0102 |
| Compound Name: | 6-[4-(5-bromopyridine-3-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 483.36 |
| Molecular Formula: | C17 H15 Br N4 O4 S2 |
| Smiles: | C1CN(CCN1C(c1cc(cnc1)[Br])=O)S(c1ccc2c(c1)SC(N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2252 |
| logD: | 2.2035 |
| logSw: | -2.7211 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.161 |
| InChI Key: | KUMGOYFYLHPCDU-UHFFFAOYSA-N |