3-({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-diethoxyquinazoline-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-diethoxyquinazoline-2,4(1H,3H)-dione
3-({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-diethoxyquinazoline-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | K221-3028 |
| Compound Name: | 3-({4-[4-(3-chlorophenyl)piperazine-1-carbonyl]phenyl}methyl)-6,7-diethoxyquinazoline-2,4(1H,3H)-dione |
| Molecular Weight: | 563.05 |
| Molecular Formula: | C30 H31 Cl N4 O5 |
| Smiles: | CCOc1cc2C(N(Cc3ccc(cc3)C(N3CCN(CC3)c3cccc(c3)[Cl])=O)C(Nc2cc1OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0469 |
| logD: | 4.0416 |
| logSw: | -4.3484 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.809 |
| InChI Key: | LNXSFUWYHPYSKI-UHFFFAOYSA-N |