2-{2-[4-(2-methoxyphenyl)piperazin-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-(2-methoxyphenyl)piperazin-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-(2-methoxyphenyl)piperazin-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: | C200-8791 |
| Compound Name: | 2-{2-[4-(2-methoxyphenyl)piperazin-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: | 536.63 |
| Molecular Formula: | C25 H24 N6 O4 S2 |
| Smiles: | COc1ccccc1N1CCN(CC1)C(CN1C(N2C(=N1)N(Cc1cccs1)C(c1c2ccs1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8694 |
| logD: | 2.869 |
| logSw: | -3.2014 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.954 |
| InChI Key: | JLYSPDCMJAWHSE-UHFFFAOYSA-N |