6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(2-fluorophenyl)methoxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(2-fluorophenyl)methoxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(2-fluorophenyl)methoxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 8011-8993 |
| Compound Name: | 6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-{4-[(2-fluorophenyl)methoxy]phenyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 482.47 |
| Molecular Formula: | C27 H19 F N4 O4 |
| Smiles: | C(c1ccccc1F)Oc1ccc(cc1)C1C(C#N)=C(N)Oc2c1c(c1ccc3c(c1)OCO3)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4329 |
| logD: | 4.4329 |
| logSw: | -4.6963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.816 |
| InChI Key: | WMSCLOSVNGUANL-QHCPKHFHSA-N |