9'-bromo-2'-(4-methoxyphenyl)-1-(prop-2-en-1-yl)-1',10'b-dihydrospiro[indole-3,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2(1H)-one
Chemical Structure Depiction of
9'-bromo-2'-(4-methoxyphenyl)-1-(prop-2-en-1-yl)-1',10'b-dihydrospiro[indole-3,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2(1H)-one
9'-bromo-2'-(4-methoxyphenyl)-1-(prop-2-en-1-yl)-1',10'b-dihydrospiro[indole-3,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2(1H)-one
Compound characteristics
| Compound ID: | 4663-2462 |
| Compound Name: | 9'-bromo-2'-(4-methoxyphenyl)-1-(prop-2-en-1-yl)-1',10'b-dihydrospiro[indole-3,5'-pyrazolo[1,5-c][1,3]benzoxazin]-2(1H)-one |
| Molecular Weight: | 516.39 |
| Molecular Formula: | C27 H22 Br N3 O3 |
| Smiles: | COc1ccc(cc1)C1CC2c3cc(ccc3OC3(C(N(CC=C)c4ccccc34)=O)N2N=1)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.1201 |
| logD: | 6.1201 |
| logSw: | -5.5045 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.801 |
| InChI Key: | XGSVKBZRNHODRV-UHFFFAOYSA-N |