3-benzyl-1-{[3-(4-chloro-3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-benzyl-1-{[3-(4-chloro-3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-benzyl-1-{[3-(4-chloro-3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L927-0255 |
| Compound Name: | 3-benzyl-1-{[3-(4-chloro-3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 468.89 |
| Molecular Formula: | C22 H14 Cl F N4 O3 S |
| Smiles: | C(c1ccccc1)N1C(c2c(ccs2)N(Cc2nc(c3ccc(c(c3)F)[Cl])no2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6593 |
| logD: | 5.6593 |
| logSw: | -6.0187 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.628 |
| InChI Key: | XVSVXKBRJCDQIB-UHFFFAOYSA-N |