4-(2-methylpropyl)-1-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-(2-methylpropyl)-1-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-(2-methylpropyl)-1-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | F084-0311 |
| Compound Name: | 4-(2-methylpropyl)-1-[3-oxo-3-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)propyl]thieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 461.59 |
| Molecular Formula: | C25 H27 N5 O2 S |
| Smiles: | CC(C)CN1C(c2c(ccs2)n2c(CCC(N3CCC(=CC3)c3ccccc3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9113 |
| logD: | 3.9113 |
| logSw: | -3.9169 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.117 |
| InChI Key: | IEEVAUVZBJJJDF-UHFFFAOYSA-N |