N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide
N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | K415-0318 |
| Compound Name: | N-{4-[5-(4-bromophenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 425.3 |
| Molecular Formula: | C19 H13 Br N4 O S |
| Smiles: | c1cc(C(Nc2ccc(cc2)n2c(cnn2)c2ccc(cc2)[Br])=O)sc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1361 |
| logD: | 5.1361 |
| logSw: | -5.3518 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.332 |
| InChI Key: | NGKQXGLEDGIJCA-UHFFFAOYSA-N |