methyl 4-(6-amino-5-cyano-3-propyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
Chemical Structure Depiction of
methyl 4-(6-amino-5-cyano-3-propyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
methyl 4-(6-amino-5-cyano-3-propyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
Compound characteristics
Compound ID: | 3448-7870 |
Compound Name: | methyl 4-(6-amino-5-cyano-3-propyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate |
Molecular Weight: | 338.36 |
Molecular Formula: | C18 H18 N4 O3 |
Smiles: | CCCc1c2C(C(C#N)=C(N)Oc2[nH]n1)c1ccc(cc1)C(=O)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 2.5972 |
logD: | 2.5972 |
logSw: | -2.9677 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 92.414 |
InChI Key: | IXGWYMNIBFIIOR-AWEZNQCLSA-N |