N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-tert-butylbenzamide
Chemical Structure Depiction of
N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-tert-butylbenzamide
N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-tert-butylbenzamide
Compound characteristics
| Compound ID: | 8008-6368 |
| Compound Name: | N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-4-tert-butylbenzamide |
| Molecular Weight: | 539.51 |
| Molecular Formula: | C26 H23 Br N2 O2 S2 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1ccc2c(c1)sc(n2)SCC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.8952 |
| logD: | 7.8944 |
| logSw: | -5.5972 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.387 |
| InChI Key: | AVLOSSSQUATGRS-UHFFFAOYSA-N |