5-(2-methylphenyl)-3-[(4-nitrophenoxy)methyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-(2-methylphenyl)-3-[(4-nitrophenoxy)methyl]-1,2,4-oxadiazole
5-(2-methylphenyl)-3-[(4-nitrophenoxy)methyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | V006-5560 |
| Compound Name: | 5-(2-methylphenyl)-3-[(4-nitrophenoxy)methyl]-1,2,4-oxadiazole |
| Molecular Weight: | 311.29 |
| Molecular Formula: | C16 H13 N3 O4 |
| Smiles: | Cc1ccccc1c1nc(COc2ccc(cc2)[N+]([O-])=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.6878 |
| logD: | 3.6878 |
| logSw: | -3.9617 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.515 |
| InChI Key: | HSOCNCMJPYSALE-UHFFFAOYSA-N |