9-chloro-5-(3-chlorophenyl)-2-(5-methylfuran-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
9-chloro-5-(3-chlorophenyl)-2-(5-methylfuran-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
9-chloro-5-(3-chlorophenyl)-2-(5-methylfuran-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
| Compound ID: | K805-0654 |
| Compound Name: | 9-chloro-5-(3-chlorophenyl)-2-(5-methylfuran-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
| Molecular Weight: | 399.27 |
| Molecular Formula: | C21 H16 Cl2 N2 O2 |
| Smiles: | Cc1ccc(C2CC3c4cc(ccc4OC(c4cccc(c4)[Cl])N3N=2)[Cl])o1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.1813 |
| logD: | 6.1813 |
| logSw: | -6.2856 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.1382 |
| InChI Key: | TYKAYCAFUHXBGH-UHFFFAOYSA-N |