N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | C487-0056 |
| Compound Name: | N-[(furan-2-yl)methyl]-3-(4-methylphenyl)-2,4-dioxo-1-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 577.64 |
| Molecular Formula: | C33 H31 N5 O5 |
| Smiles: | Cc1ccc(cc1)N1C(c2ccc(cc2N(CC(N2CCN(CC2)c2ccccc2)=O)C1=O)C(NCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5807 |
| logD: | 3.5806 |
| logSw: | -3.8126 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.47 |
| InChI Key: | XFBJKOKBCCYXTK-UHFFFAOYSA-N |