4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-bromobenzoate
Chemical Structure Depiction of
4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-bromobenzoate
4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-bromobenzoate
Compound characteristics
| Compound ID: | 3168-0369 |
| Compound Name: | 4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-bromobenzoate |
| Molecular Weight: | 604.3 |
| Molecular Formula: | C29 H20 Br2 N2 O3 |
| Smiles: | C1C2c3ccccc3OC(c3ccc(cc3)OC(c3ccc(cc3)[Br])=O)N2N=C1c1ccc(cc1)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.0578 |
| logD: | 8.0578 |
| logSw: | -6.2884 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.424 |
| InChI Key: | NLHVIZWNUMCLDJ-UHFFFAOYSA-N |