3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}-N-[(2-methoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}-N-[(2-methoxyphenyl)methyl]propanamide
3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}-N-[(2-methoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | C260-1213 |
| Compound Name: | 3-{2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydroquinazolin-3(2H)-yl}-N-[(2-methoxyphenyl)methyl]propanamide |
| Molecular Weight: | 555.63 |
| Molecular Formula: | C31 H33 N5 O5 |
| Smiles: | COc1ccccc1CNC(CCN1C(c2ccccc2N(CC(N2CCN(CC2)c2ccccc2)=O)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7027 |
| logD: | 2.7026 |
| logSw: | -3.4243 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83 |
| InChI Key: | AXJATQFTTFRPSC-UHFFFAOYSA-N |