3-(4-ethylphenyl)-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(4-ethylphenyl)-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
3-(4-ethylphenyl)-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C258-0507 |
| Compound Name: | 3-(4-ethylphenyl)-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 528.67 |
| Molecular Formula: | C30 H32 N4 O3 S |
| Smiles: | CCc1ccc(cc1)N1C(c2c3CCCCc3sc2N(CC(N2CCN(CC2)c2ccccc2)=O)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9569 |
| logD: | 4.9568 |
| logSw: | -4.6601 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.68 |
| InChI Key: | QNFZNXCCZDGMLM-UHFFFAOYSA-N |