rel-(1R,3S)-3-(4-chlorophenyl)-2,2-dicyanocyclopropane-1-carboxamide
Chemical Structure Depiction of
rel-(1R,3S)-3-(4-chlorophenyl)-2,2-dicyanocyclopropane-1-carboxamide
rel-(1R,3S)-3-(4-chlorophenyl)-2,2-dicyanocyclopropane-1-carboxamide
Compound characteristics
Compound ID: | 8007-0194 |
Compound Name: | rel-(1R,3S)-3-(4-chlorophenyl)-2,2-dicyanocyclopropane-1-carboxamide |
Molecular Weight: | 245.67 |
Molecular Formula: | C12 H8 Cl N3 O |
Smiles: | C(C1(C#N)[C@H](c2ccc(cc2)[Cl])[C@H]1C(N)=O)#N |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.625 |
logD: | 1.6249 |
logSw: | -2.6302 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.661 |
InChI Key: | JYQNCAXINRLPRS-UWVGGRQHSA-N |