2-amino-5-(1H-benzotriazol-1-yl)-6-methyl-4-phenyl-4H-pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-(1H-benzotriazol-1-yl)-6-methyl-4-phenyl-4H-pyran-3-carbonitrile
2-amino-5-(1H-benzotriazol-1-yl)-6-methyl-4-phenyl-4H-pyran-3-carbonitrile
Compound characteristics
Compound ID: | 8009-2467 |
Compound Name: | 2-amino-5-(1H-benzotriazol-1-yl)-6-methyl-4-phenyl-4H-pyran-3-carbonitrile |
Molecular Weight: | 329.36 |
Molecular Formula: | C19 H15 N5 O |
Smiles: | CC1=C(C(C(C#N)=C(N)O1)c1ccccc1)n1c2ccccc2nn1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.5661 |
logD: | 2.5661 |
logSw: | -2.8009 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.173 |
InChI Key: | KCHZSQYIEAAJMH-QGZVFWFLSA-N |