6-[4-(3-bromobenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(3-bromobenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
6-[4-(3-bromobenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0116 |
| Compound Name: | 6-[4-(3-bromobenzoyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 482.37 |
| Molecular Formula: | C18 H16 Br N3 O4 S2 |
| Smiles: | C1CN(CCN1C(c1cccc(c1)[Br])=O)S(c1ccc2c(c1)SC(N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0602 |
| logD: | 3.0385 |
| logSw: | -3.5122 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.553 |
| InChI Key: | HMVWWRLOSVRPAM-UHFFFAOYSA-N |