2-(methylsulfanyl)-6-(thiophen-2-yl)-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
Chemical Structure Depiction of
2-(methylsulfanyl)-6-(thiophen-2-yl)-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
2-(methylsulfanyl)-6-(thiophen-2-yl)-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
Compound characteristics
| Compound ID: | D718-0339 |
| Compound Name: | 2-(methylsulfanyl)-6-(thiophen-2-yl)-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one |
| Molecular Weight: | 316.4 |
| Molecular Formula: | C14 H12 N4 O S2 |
| Smiles: | CSc1nc2N=C3CC(CC(C3=Cn2n1)=O)c1cccs1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2269 |
| logD: | 2.2269 |
| logSw: | -2.5777 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.411 |
| InChI Key: | DNZBZTRFWBUNER-QMMMGPOBSA-N |