6-{4-[(2-bromophenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[(2-bromophenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
6-{4-[(2-bromophenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0006 |
| Compound Name: | 6-{4-[(2-bromophenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 496.4 |
| Molecular Formula: | C19 H18 Br N3 O4 S2 |
| Smiles: | C(C(N1CCN(CC1)S(c1ccc2c(c1)SC(N2)=O)(=O)=O)=O)c1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.3156 |
| logD: | 3.2939 |
| logSw: | -3.629 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.026 |
| InChI Key: | AAHDGYLMNMONCB-UHFFFAOYSA-N |