N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | 8008-6316 |
| Compound Name: | N-(2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 483.4 |
| Molecular Formula: | C22 H15 Br N2 O2 S2 |
| Smiles: | C(C(c1ccc(cc1)[Br])=O)Sc1nc2ccc(cc2s1)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9956 |
| logD: | 5.995 |
| logSw: | -6.0621 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.387 |
| InChI Key: | BCHOLMGCKQCKDM-UHFFFAOYSA-N |