5-[4-(octyloxy)phenyl]-2-phenyl-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
5-[4-(octyloxy)phenyl]-2-phenyl-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
5-[4-(octyloxy)phenyl]-2-phenyl-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
| Compound ID: | 3168-0155 |
| Compound Name: | 5-[4-(octyloxy)phenyl]-2-phenyl-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
| Molecular Weight: | 454.61 |
| Molecular Formula: | C30 H34 N2 O2 |
| Smiles: | CCCCCCCCOc1ccc(cc1)C1N2C(CC(c3ccccc3)=N2)c2ccccc2O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.6557 |
| logD: | 8.6557 |
| logSw: | -5.9982 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.4635 |
| InChI Key: | NVEFSQIIGWPOBV-UHFFFAOYSA-N |