4-[(furan-2-yl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Chemical Structure Depiction of
4-[(furan-2-yl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
4-[(furan-2-yl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Compound characteristics
| Compound ID: | C200-7833 |
| Compound Name: | 4-[(furan-2-yl)methyl]-1-sulfanylidene-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one |
| Molecular Weight: | 304.35 |
| Molecular Formula: | C12 H8 N4 O2 S2 |
| Smiles: | C(c1ccco1)N1C2=NNC(N2c2ccsc2C1=O)=S |
| Stereo: | ACHIRAL |
| logP: | 2.1717 |
| logD: | -4.3 |
| logSw: | -2.6316 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.141 |
| InChI Key: | YWJMVLRQYHISBY-UHFFFAOYSA-N |