4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[(4-methylphenyl)methyl]butanamide
Chemical Structure Depiction of
4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[(4-methylphenyl)methyl]butanamide
4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[(4-methylphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | E596-0389 |
| Compound Name: | 4-(4-ethyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[(4-methylphenyl)methyl]butanamide |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C21 H23 N5 O2 S |
| Smiles: | CCN1C(c2c(ccs2)n2c(CCCC(NCc3ccc(C)cc3)=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4016 |
| logD: | 2.4016 |
| logSw: | -2.7521 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.192 |
| InChI Key: | IAYGWSPFUUQEGH-UHFFFAOYSA-N |