4-(2-methylpropyl)-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Chemical Structure Depiction of
4-(2-methylpropyl)-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
4-(2-methylpropyl)-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Compound characteristics
| Compound ID: | C200-7093 |
| Compound Name: | 4-(2-methylpropyl)-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one |
| Molecular Weight: | 280.37 |
| Molecular Formula: | C11 H12 N4 O S2 |
| Smiles: | CC(C)CN1C2=NNC(N2c2ccsc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 2.5575 |
| logD: | -4.4829 |
| logSw: | -2.8058 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.664 |
| InChI Key: | LXGAKTQSVQZZDR-UHFFFAOYSA-N |