ethyl 5-[(4-methylphenyl)methyl]-1,3,4-oxadiazole-2-carboxylate
Chemical Structure Depiction of
ethyl 5-[(4-methylphenyl)methyl]-1,3,4-oxadiazole-2-carboxylate
ethyl 5-[(4-methylphenyl)methyl]-1,3,4-oxadiazole-2-carboxylate
Compound characteristics
| Compound ID: | C301-3321 |
| Compound Name: | ethyl 5-[(4-methylphenyl)methyl]-1,3,4-oxadiazole-2-carboxylate |
| Molecular Weight: | 246.26 |
| Molecular Formula: | C13 H14 N2 O3 |
| Smiles: | CCOC(c1nnc(Cc2ccc(C)cc2)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3699 |
| logD: | 2.3699 |
| logSw: | -2.3849 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.173 |
| InChI Key: | KDQHFGMTCSHGBQ-UHFFFAOYSA-N |