4-(3-bromophenyl)-7,7-dimethyl-3-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Chemical Structure Depiction of
4-(3-bromophenyl)-7,7-dimethyl-3-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
4-(3-bromophenyl)-7,7-dimethyl-3-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Compound characteristics
| Compound ID: | E710-0032 |
| Compound Name: | 4-(3-bromophenyl)-7,7-dimethyl-3-phenyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one |
| Molecular Weight: | 448.36 |
| Molecular Formula: | C24 H22 Br N3 O |
| Smiles: | CC1(C)CC2=C(C(c3cccc(c3)[Br])c3c(c4ccccc4)n[nH]c3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3117 |
| logD: | 5.3099 |
| logSw: | -5.3486 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.106 |
| InChI Key: | XKEPVSNMDWHMTM-IBGZPJMESA-N |