2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3-(4-chlorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3-(4-chlorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3-(4-chlorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F425-0184 |
| Compound Name: | 2-({[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-3-(4-chlorophenyl)thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 496.95 |
| Molecular Formula: | C22 H13 Cl N4 O4 S2 |
| Smiles: | C1Oc2ccc(cc2O1)c1nc(CSC2=Nc3ccsc3C(N2c2ccc(cc2)[Cl])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.5751 |
| logD: | 5.5751 |
| logSw: | -6.121 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.636 |
| InChI Key: | BVLCOUHNRSDTDF-UHFFFAOYSA-N |