N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | 2513-1935 |
| Compound Name: | N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 428.23 |
| Molecular Formula: | C16 H9 Br F3 N3 O S |
| Smiles: | c1cc(cc(c1)C(F)(F)F)C(Nc1nnc(c2ccc(cc2)[Br])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4682 |
| logD: | 5.4502 |
| logSw: | -6.1494 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.603 |
| InChI Key: | ITJHHKWHXPBTCK-UHFFFAOYSA-N |