N-[(3-methoxyphenyl)methyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
N-[(3-methoxyphenyl)methyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
Compound characteristics
| Compound ID: | E596-0862 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C23 H27 N5 O3 S |
| Smiles: | CC(C)CN1C(c2c(ccs2)n2c(CCCC(NCc3cccc(c3)OC)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0169 |
| logD: | 3.0169 |
| logSw: | -3.5218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.011 |
| InChI Key: | YGLXJZNHCZNLBK-UHFFFAOYSA-N |