9-chloro-5-(2,5-dimethoxyphenyl)-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
9-chloro-5-(2,5-dimethoxyphenyl)-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
9-chloro-5-(2,5-dimethoxyphenyl)-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
| Compound ID: | K805-0725 |
| Compound Name: | 9-chloro-5-(2,5-dimethoxyphenyl)-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C22 H19 Cl N2 O3 S |
| Smiles: | COc1ccc(c(c1)C1N2C(CC(c3cccs3)=N2)c2cc(ccc2O1)[Cl])OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9212 |
| logD: | 5.9212 |
| logSw: | -6.1762 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.238 |
| InChI Key: | GVAILLQFWRPENC-UHFFFAOYSA-N |