2,4-dibenzyl-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
2,4-dibenzyl-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
2,4-dibenzyl-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | 8009-2187 |
| Compound Name: | 2,4-dibenzyl-6-methyl-3-sulfanylidene-3,4-dihydro-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 323.41 |
| Molecular Formula: | C18 H17 N3 O S |
| Smiles: | CC1C(N(Cc2ccccc2)C(N(Cc2ccccc2)N=1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4134 |
| logD: | 3.4134 |
| logSw: | -3.5778 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.5297 |
| InChI Key: | HTOBCBDCRKMOLV-UHFFFAOYSA-N |