2-[9-bromo-5-(thiophen-3-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl]phenol
Chemical Structure Depiction of
2-[9-bromo-5-(thiophen-3-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl]phenol
2-[9-bromo-5-(thiophen-3-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl]phenol
Compound characteristics
| Compound ID: | 7896-0123 |
| Compound Name: | 2-[9-bromo-5-(thiophen-3-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl]phenol |
| Molecular Weight: | 427.32 |
| Molecular Formula: | C20 H15 Br N2 O2 S |
| Smiles: | C1C2c3cc(ccc3OC(c3ccsc3)N2N=C1c1ccccc1O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9101 |
| logD: | 5.9066 |
| logSw: | -5.7232 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.612 |
| InChI Key: | GORQYQJYNCVMMB-UHFFFAOYSA-N |