6-amino-4-{3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-{3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | Y500-0336 |
| Compound Name: | 6-amino-4-{3-[(2,4-difluorophenoxy)methyl]-4-methoxyphenyl}-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 486.48 |
| Molecular Formula: | C27 H20 F2 N4 O3 |
| Smiles: | COc1ccc(cc1COc1ccc(cc1F)F)C1C(C#N)=C(N)Oc2c1c(c1ccccc1)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3103 |
| logD: | 4.3103 |
| logSw: | -4.5607 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.418 |
| InChI Key: | MBRDSRAEHJSURG-QHCPKHFHSA-N |