4-[2-(4-chlorophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl benzoate
Chemical Structure Depiction of
4-[2-(4-chlorophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl benzoate
4-[2-(4-chlorophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl benzoate
Compound characteristics
Compound ID: | 3168-0353 |
Compound Name: | 4-[2-(4-chlorophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl benzoate |
Molecular Weight: | 480.95 |
Molecular Formula: | C29 H21 Cl N2 O3 |
Smiles: | C1C2c3ccccc3OC(c3ccc(cc3)OC(c3ccccc3)=O)N2N=C1c1ccc(cc1)[Cl] |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 6.8796 |
logD: | 6.8796 |
logSw: | -6.5915 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.424 |
InChI Key: | YPUMUFUQGLONMK-UHFFFAOYSA-N |