4,5,7-trimethyl-3-sulfanylideneoctahydro-6H-imidazo[4,5-e][1,2,4]triazin-6-one
Chemical Structure Depiction of
4,5,7-trimethyl-3-sulfanylideneoctahydro-6H-imidazo[4,5-e][1,2,4]triazin-6-one
4,5,7-trimethyl-3-sulfanylideneoctahydro-6H-imidazo[4,5-e][1,2,4]triazin-6-one
Compound characteristics
| Compound ID: | 8010-6431 |
| Compound Name: | 4,5,7-trimethyl-3-sulfanylideneoctahydro-6H-imidazo[4,5-e][1,2,4]triazin-6-one |
| Molecular Weight: | 215.27 |
| Molecular Formula: | C7 H13 N5 O S |
| Smiles: | CN1C2C(N(C)C1=O)N(C)C(NN2)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.9235 |
| logD: | -0.9258 |
| logSw: | -1.3606 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.535 |
| InChI Key: | TYFPRPPVBNEGDJ-UHFFFAOYSA-N |