3-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
3-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C172-0243 |
| Compound Name: | 3-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C21 H22 N4 O4 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)C(CCN1C(c2c(ccs2)NC1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6623 |
| logD: | 1.6617 |
| logSw: | -2.4235 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.957 |
| InChI Key: | XQQYSSDOURLZGM-UHFFFAOYSA-N |