N-{4-[3-(2-methylpropoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{4-[3-(2-methylpropoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}thiophene-2-carboxamide
N-{4-[3-(2-methylpropoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V025-0078 |
| Compound Name: | N-{4-[3-(2-methylpropoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C21 H20 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2cccs2)n(c2ccc(cc2)NC(c2cccs2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6614 |
| logD: | 5.6613 |
| logSw: | -5.4414 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.317 |
| InChI Key: | NFOULZIDHRBEJA-UHFFFAOYSA-N |