4-cyanophenyl 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
4-cyanophenyl 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylate
4-cyanophenyl 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | D337-1491 |
| Compound Name: | 4-cyanophenyl 5-(3,4-dimethylphenyl)-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 318.33 |
| Molecular Formula: | C19 H14 N2 O3 |
| Smiles: | Cc1ccc(cc1C)c1cc(C(=O)Oc2ccc(C#N)cc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.574 |
| logD: | 4.574 |
| logSw: | -4.4852 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.208 |
| InChI Key: | XTHKHLJCYJCAQO-UHFFFAOYSA-N |