6,7-dimethoxy-3-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methyl)quinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
6,7-dimethoxy-3-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methyl)quinazoline-2,4(1H,3H)-dione
6,7-dimethoxy-3-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methyl)quinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C191-0258 |
| Compound Name: | 6,7-dimethoxy-3-({4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl}methyl)quinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 545.55 |
| Molecular Formula: | C28 H27 N5 O7 |
| Smiles: | COc1cc2C(N(Cc3ccc(cc3)C(N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)=O)C(Nc2cc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2192 |
| logD: | 3.214 |
| logSw: | -3.5126 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 109.031 |
| InChI Key: | HIIURIJRSYOEDA-UHFFFAOYSA-N |