4-[(oxolan-2-yl)methyl]-2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-[(oxolan-2-yl)methyl]-2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-[(oxolan-2-yl)methyl]-2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | F816-0643 |
| Compound Name: | 4-[(oxolan-2-yl)methyl]-2-{[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 465.53 |
| Molecular Formula: | C23 H23 N5 O4 S |
| Smiles: | C1CC(N(C1)c1ccc(CN2C(N3C(=N2)N(CC2CCCO2)C(c2c3ccs2)=O)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2787 |
| logD: | 2.2787 |
| logSw: | -2.5707 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.424 |
| InChI Key: | NFDVAXKQXUILBD-QGZVFWFLSA-N |