N-[3-(4-benzylpiperazin-1-yl)propyl]-6-bromo-3-(2,4-dimethoxyphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-6-bromo-3-(2,4-dimethoxyphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-6-bromo-3-(2,4-dimethoxyphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide
Compound characteristics
| Compound ID: | C109-1057 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-6-bromo-3-(2,4-dimethoxyphenyl)-4-hydroxy-2-oxo-1,2,3,4-tetrahydroquinazoline-4-carboxamide |
| Molecular Weight: | 638.56 |
| Molecular Formula: | C31 H36 Br N5 O5 |
| Smiles: | COc1ccc(c(c1)OC)N1C(Nc2ccc(cc2C1(C(NCCCN1CCN(CC1)Cc1ccccc1)=O)O)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8878 |
| logD: | 3.0682 |
| logSw: | -4.0021 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.343 |
| InChI Key: | MHUXKJBOPIMKAD-WJOKGBTCSA-N |