4-benzyl-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Chemical Structure Depiction of
4-benzyl-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
4-benzyl-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Compound characteristics
| Compound ID: | C200-7262 |
| Compound Name: | 4-benzyl-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C14 H10 N4 O S2 |
| Smiles: | C(c1ccccc1)N1C2=NNC(N2c2ccsc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 2.9183 |
| logD: | -3.4791 |
| logSw: | -3.2902 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.393 |
| InChI Key: | MRNAHARNHZTTHM-UHFFFAOYSA-N |