4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-methylphenyl)ethyl]butanamide
Chemical Structure Depiction of
4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-methylphenyl)ethyl]butanamide
4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-methylphenyl)ethyl]butanamide
Compound characteristics
| Compound ID: | C200-2779 |
| Compound Name: | 4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)-N-[2-(4-methylphenyl)ethyl]butanamide |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C21 H23 N5 O2 S |
| Smiles: | Cc1ccc(CCNC(CCCc2nnc3N(C)C(c4c(ccs4)n23)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6385 |
| logD: | 1.6385 |
| logSw: | -2.4128 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.075 |
| InChI Key: | IGMSNTWSVATOQZ-UHFFFAOYSA-N |