methyl 4-[5-methyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]benzoate
Chemical Structure Depiction of
methyl 4-[5-methyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]benzoate
methyl 4-[5-methyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]benzoate
Compound characteristics
| Compound ID: | G026-0044 |
| Compound Name: | methyl 4-[5-methyl-4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]benzoate |
| Molecular Weight: | 361.36 |
| Molecular Formula: | C19 H15 N5 O3 |
| Smiles: | Cc1c(c2nc(c3ccccc3)no2)nnn1c1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7427 |
| logD: | 3.7427 |
| logSw: | -4.141 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 79.661 |
| InChI Key: | ZDKJRCPMRXGWEP-UHFFFAOYSA-N |