2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0824 |
| Compound Name: | 2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-4-(2-phenylethyl)-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 485.56 |
| Molecular Formula: | C26 H23 N5 O3 S |
| Smiles: | C1CC(N(C1)c1ccc(CN2C(N3C(=N2)N(CCc2ccccc2)C(c2c3ccs2)=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.935 |
| logD: | 3.935 |
| logSw: | -4.0044 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.748 |
| InChI Key: | DZGJHPHXBJPOSF-UHFFFAOYSA-N |