9-bromo-2-(4-methylphenyl)-5-(pyridin-4-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
9-bromo-2-(4-methylphenyl)-5-(pyridin-4-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
9-bromo-2-(4-methylphenyl)-5-(pyridin-4-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
| Compound ID: | 6835-5636 |
| Compound Name: | 9-bromo-2-(4-methylphenyl)-5-(pyridin-4-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
| Molecular Weight: | 420.31 |
| Molecular Formula: | C22 H18 Br N3 O |
| Smiles: | Cc1ccc(cc1)C1CC2c3cc(ccc3OC(c3ccncc3)N2N=1)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3274 |
| logD: | 5.3251 |
| logSw: | -5.3129 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 31.474 |
| InChI Key: | CCSMNTBDSZUBNP-UHFFFAOYSA-N |