methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | K221-2607 |
| Compound Name: | methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate |
| Molecular Weight: | 430.5 |
| Molecular Formula: | C22 H30 N4 O5 |
| Smiles: | CCN1CCN(CC1)C(CCCCCN1C(c2ccc(cc2NC1=O)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.951 |
| logD: | 1.6306 |
| logSw: | -2.7803 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.562 |
| InChI Key: | LSRCPXCDWYQYEQ-UHFFFAOYSA-N |