N-[2-(3,4-diethoxyphenyl)ethyl]-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-[2-(3,4-diethoxyphenyl)ethyl]-4-[4-(2-methylpropyl)-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]butanamide
N-[2-(3,4-diethoxyphenyl)ethyl]-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: | C200-2885 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-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: | 525.67 |
| Molecular Formula: | C27 H35 N5 O4 S |
| Smiles: | CCOc1ccc(CCNC(CCCc2nnc3N(CC(C)C)C(c4c(ccs4)n23)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.7026 |
| logD: | 2.7026 |
| logSw: | -3.225 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.73 |
| InChI Key: | UHWRIFMVWAPBEI-UHFFFAOYSA-N |