6-amino-4-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-(naphthalen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-(naphthalen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-(naphthalen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 3629-0357 |
Compound Name: | 6-amino-4-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-(naphthalen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 492.62 |
Molecular Formula: | C31 H32 N4 O2 |
Smiles: | CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C1C(C#N)=C(N)Oc2c1c(c1ccc3ccccc3c1)n[nH]2 |
Stereo: | RACEMIC MIXTURE |
logP: | 6.8778 |
logD: | 6.8778 |
logSw: | -6.5099 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 85.681 |
InChI Key: | JMTYPCJLSKTPPU-XMMPIXPASA-N |