4-butyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Chemical Structure Depiction of
4-butyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
4-butyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione
Compound characteristics
| Compound ID: | L397-0500 |
| Compound Name: | 4-butyl-2-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidine-1,5-dione |
| Molecular Weight: | 496.59 |
| Molecular Formula: | C24 H28 N6 O4 S |
| Smiles: | CCCCN1C2=NN(CC(N3CCN(CC3)c3ccc(cc3)OC)=O)C(N2c2ccsc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9778 |
| logD: | 2.9773 |
| logSw: | -3.2796 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.4 |
| InChI Key: | GFDPTNGCPTZXRF-UHFFFAOYSA-N |