4-(benzylideneamino)-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
4-(benzylideneamino)-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
4-(benzylideneamino)-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | 2279-3445 |
| Compound Name: | 4-(benzylideneamino)-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 246.29 |
| Molecular Formula: | C11 H10 N4 O S |
| Smiles: | CC1C(N(C(NN=1)=S)/N=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3372 |
| logD: | 1.241 |
| logSw: | -2.3222 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.692 |
| InChI Key: | MOOMLGXYYAWRCU-UHFFFAOYSA-N |