4-[2-(4-methylphenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate
Chemical Structure Depiction of
4-[2-(4-methylphenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate
4-[2-(4-methylphenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 3168-0358 |
| Compound Name: | 4-[2-(4-methylphenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C31 H26 N2 O3 |
| Smiles: | Cc1ccc(cc1)C1CC2c3ccccc3OC(c3ccc(cc3)OC(c3ccc(C)cc3)=O)N2N=1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.2367 |
| logD: | 7.2367 |
| logSw: | -5.8903 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.424 |
| InChI Key: | ZHCWKUBSAVXAFK-UHFFFAOYSA-N |