2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-(4-phenylbutan-2-yl)acetamide
2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | L397-0247 |
| Compound Name: | 2-[4-(3-methylbutyl)-1,5-dioxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-2(1H)-yl]-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 467.59 |
| Molecular Formula: | C24 H29 N5 O3 S |
| Smiles: | CC(C)CCN1C2=NN(CC(NC(C)CCc3ccccc3)=O)C(N2c2ccsc2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1326 |
| logD: | 4.1326 |
| logSw: | -4.0651 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.117 |
| InChI Key: | VJFMZMDBOHRBFO-KRWDZBQOSA-N |