methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate
methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate
Compound characteristics
| Compound ID: | G026-0274 |
| Compound Name: | methyl 4-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-5-methyl-1H-1,2,3-triazol-1-yl}benzoate |
| Molecular Weight: | 395.8 |
| Molecular Formula: | C19 H14 Cl N5 O3 |
| Smiles: | Cc1c(c2nc(c3ccc(cc3)[Cl])no2)nnn1c1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.4425 |
| logD: | 4.4425 |
| logSw: | -4.6557 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 79.661 |
| InChI Key: | QPYKDLFUHCPXSB-UHFFFAOYSA-N |