N-{[4-(2-methoxyphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[4-(2-methoxyphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
N-{[4-(2-methoxyphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 3330-3020 |
| Compound Name: | N-{[4-(2-methoxyphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C15 H14 N4 O2 S2 |
| Smiles: | COc1ccccc1N1C(CNC(c2cccs2)=O)=NNC1=S |
| Stereo: | ACHIRAL |
| logP: | 2.309 |
| logD: | 2.066 |
| logSw: | -2.5767 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.862 |
| InChI Key: | PPYPPFFQKYOJFF-UHFFFAOYSA-N |