1-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
1-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
1-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F401-0414 |
| Compound Name: | 1-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-4-(2-phenylpropyl)thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 515.66 |
| Molecular Formula: | C27 H25 N5 O2 S2 |
| Smiles: | CC(CN1C(c2c(ccs2)n2c1nnc2SCc1ccc(cc1)N1CCCC1=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.097 |
| logD: | 5.097 |
| logSw: | -4.7558 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.147 |
| InChI Key: | JEJZJDHCMKZPER-SFHVURJKSA-N |