4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate
Chemical Structure Depiction of
4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate
4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 3168-0362 |
| Compound Name: | 4-[2-(4-bromophenyl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenyl 4-methylbenzoate |
| Molecular Weight: | 539.43 |
| Molecular Formula: | C30 H23 Br N2 O3 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1ccc(cc1)C1N2C(CC(c3ccc(cc3)[Br])=N2)c2ccccc2O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.6473 |
| logD: | 7.6472 |
| logSw: | -5.9327 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.424 |
| InChI Key: | FMMQSTFDVWUCMN-UHFFFAOYSA-N |