N-{[4-(4-fluorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[4-(4-fluorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
N-{[4-(4-fluorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 3330-3022 |
| Compound Name: | N-{[4-(4-fluorophenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide |
| Molecular Weight: | 334.39 |
| Molecular Formula: | C14 H11 F N4 O S2 |
| Smiles: | C(C1=NNC(N1c1ccc(cc1)F)=S)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4788 |
| logD: | 1.6282 |
| logSw: | -2.7514 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.532 |
| InChI Key: | AMVGNUPBNPQSJA-UHFFFAOYSA-N |