2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-4-[(thiophen-2-yl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-4-[(thiophen-2-yl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-4-[(thiophen-2-yl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | L397-0570 |
| Compound Name: | 2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-4-[(thiophen-2-yl)methyl]-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C20 H21 N5 O3 S2 |
| Smiles: | CC1CCN(CC1)C(CN1C(N2C(=N1)N(Cc1cccs1)C(c1c2ccs1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5638 |
| logD: | 2.5638 |
| logSw: | -2.6257 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.365 |
| InChI Key: | NFJDMHDLFWWWOE-UHFFFAOYSA-N |