1-[5-(6-chloro-2H-[1,3]dioxolo[4,5-g]quinolin-7-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[5-(6-chloro-2H-[1,3]dioxolo[4,5-g]quinolin-7-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
1-[5-(6-chloro-2H-[1,3]dioxolo[4,5-g]quinolin-7-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 5959-0231 |
| Compound Name: | 1-[5-(6-chloro-2H-[1,3]dioxolo[4,5-g]quinolin-7-yl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 393.83 |
| Molecular Formula: | C21 H16 Cl N3 O3 |
| Smiles: | CC(N1C(CC(c2ccccc2)=N1)c1cc2cc3c(cc2nc1[Cl])OCO3)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4218 |
| logD: | 4.4218 |
| logSw: | -4.6193 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.938 |
| InChI Key: | JZJRGFIEGZXJLL-SFHVURJKSA-N |