3-[(4-methoxyphenyl)methyl]-7-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-[(4-methoxyphenyl)methyl]-7-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione
3-[(4-methoxyphenyl)methyl]-7-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C190-0255 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-7-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 515.53 |
| Molecular Formula: | C27 H25 N5 O6 |
| Smiles: | COc1ccc(CN2C(c3ccc(cc3NC2=O)C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6569 |
| logD: | 3.6568 |
| logSw: | -3.9323 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.314 |
| InChI Key: | GLXDPMVCDHBARB-UHFFFAOYSA-N |