9-bromo-2-(4-methylphenyl)-5-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
9-bromo-2-(4-methylphenyl)-5-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
9-bromo-2-(4-methylphenyl)-5-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
| Compound ID: | 4663-2443 |
| Compound Name: | 9-bromo-2-(4-methylphenyl)-5-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
| Molecular Weight: | 425.35 |
| Molecular Formula: | C21 H17 Br N2 O S |
| Smiles: | Cc1ccc(cc1)C1CC2c3cc(ccc3OC(c3cccs3)N2N=1)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0789 |
| logD: | 6.0789 |
| logSw: | -5.6105 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 23.0641 |
| InChI Key: | NBAXVZLVEBDJEJ-UHFFFAOYSA-N |