6-amino-4-(2-chloro-6-fluorophenyl)-3-(2,4-diethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-(2-chloro-6-fluorophenyl)-3-(2,4-diethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-(2-chloro-6-fluorophenyl)-3-(2,4-diethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 8012-5051 |
Compound Name: | 6-amino-4-(2-chloro-6-fluorophenyl)-3-(2,4-diethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 454.89 |
Molecular Formula: | C23 H20 Cl F N4 O3 |
Smiles: | CCOc1ccc(c(c1)OCC)c1c2C(C(C#N)=C(N)Oc2[nH]n1)c1c(cccc1[Cl])F |
Stereo: | RACEMIC MIXTURE |
logP: | 4.0265 |
logD: | 4.0265 |
logSw: | -4.6086 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 84.807 |
InChI Key: | JWYFRBOELDXTRU-GOSISDBHSA-N |