2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Chemical Structure Depiction of
2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one
Compound characteristics
| Compound ID: | Y205-8159 |
| Compound Name: | 2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-5H-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one |
| Molecular Weight: | 339.44 |
| Molecular Formula: | C17 H13 N3 O S2 |
| Smiles: | C1CCc2c(C1)c(cs2)C1=NN2C(=Nc3ccccc3C2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.6943 |
| logD: | 3.6943 |
| logSw: | -4.1545 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.469 |
| InChI Key: | PGPMFIQSYIMFPX-UHFFFAOYSA-N |