2-[3-(dichloromethyl)-4-nitro-1-phenyl-1H-pyrazol-5-yl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[3-(dichloromethyl)-4-nitro-1-phenyl-1H-pyrazol-5-yl]-1,2,3,4-tetrahydroisoquinoline
2-[3-(dichloromethyl)-4-nitro-1-phenyl-1H-pyrazol-5-yl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | 4872-0725 |
| Compound Name: | 2-[3-(dichloromethyl)-4-nitro-1-phenyl-1H-pyrazol-5-yl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 403.27 |
| Molecular Formula: | C19 H16 Cl2 N4 O2 |
| Smiles: | C1CN(Cc2ccccc12)c1c(c(C([Cl])[Cl])nn1c1ccccc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4606 |
| logD: | 5.4606 |
| logSw: | -5.768 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.55 |
| InChI Key: | BBKVJUZZZQGWKD-UHFFFAOYSA-N |