3-[(4-methoxyphenyl)methyl]-2,4-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-2,4-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[(4-methoxyphenyl)methyl]-2,4-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | C190-0522 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-2,4-dioxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 513.6 |
| Molecular Formula: | C29 H31 N5 O4 |
| Smiles: | COc1ccc(CN2C(c3ccc(cc3NC2=O)C(NCCN2CCN(CC2)c2ccccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4462 |
| logD: | 3.4214 |
| logSw: | -3.7931 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.522 |
| InChI Key: | ORLLPGGNPFEIKC-UHFFFAOYSA-N |