4-(1H-benzotriazol-1-yl)-5-(3,4-dimethylphenoxy)benzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-(1H-benzotriazol-1-yl)-5-(3,4-dimethylphenoxy)benzene-1,2-dicarbonitrile
4-(1H-benzotriazol-1-yl)-5-(3,4-dimethylphenoxy)benzene-1,2-dicarbonitrile
Compound characteristics
Compound ID: | 8012-6086 |
Compound Name: | 4-(1H-benzotriazol-1-yl)-5-(3,4-dimethylphenoxy)benzene-1,2-dicarbonitrile |
Molecular Weight: | 365.39 |
Molecular Formula: | C22 H15 N5 O |
Smiles: | Cc1ccc(cc1C)Oc1cc(C#N)c(C#N)cc1n1c2ccccc2nn1 |
Stereo: | ACHIRAL |
logP: | 4.8688 |
logD: | 4.8688 |
logSw: | -4.6821 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 66.447 |
InChI Key: | LTVSRSIRECRYDN-UHFFFAOYSA-N |