6-amino-3-(4-butoxyphenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-3-(4-butoxyphenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-3-(4-butoxyphenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 8012-0144 |
Compound Name: | 6-amino-3-(4-butoxyphenyl)-4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 470.51 |
Molecular Formula: | C26 H23 F N6 O2 |
Smiles: | CCCCOc1ccc(cc1)c1c2C(C(C#N)=C(N)Oc2[nH]n1)c1c[nH]nc1c1ccc(cc1)F |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5355 |
logD: | 4.1542 |
logSw: | -4.3946 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 102.081 |
InChI Key: | INIGJYJIBJROBU-NRFANRHFSA-N |