2-[2-(3-methoxyphenyl)-2-oxoethyl]-4-{[4-(propan-2-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
2-[2-(3-methoxyphenyl)-2-oxoethyl]-4-{[4-(propan-2-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
2-[2-(3-methoxyphenyl)-2-oxoethyl]-4-{[4-(propan-2-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0543 |
| Compound Name: | 2-[2-(3-methoxyphenyl)-2-oxoethyl]-4-{[4-(propan-2-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C26 H24 N4 O4 S |
| Smiles: | CC(C)c1ccc(CN2C3=NN(CC(c4cccc(c4)OC)=O)C(N3c3ccsc3C2=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1628 |
| logD: | 5.1628 |
| logSw: | -5.0627 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.744 |
| InChI Key: | YXTSXVURWJAYNZ-UHFFFAOYSA-N |