5-(4-chlorophenyl)-3-{3-[(3-nitrophenyl)methoxy]phenyl}-1,2,4-oxadiazole
Chemical Structure Depiction of
5-(4-chlorophenyl)-3-{3-[(3-nitrophenyl)methoxy]phenyl}-1,2,4-oxadiazole
5-(4-chlorophenyl)-3-{3-[(3-nitrophenyl)methoxy]phenyl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | V029-6828 |
| Compound Name: | 5-(4-chlorophenyl)-3-{3-[(3-nitrophenyl)methoxy]phenyl}-1,2,4-oxadiazole |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C21 H14 Cl N3 O4 |
| Salt: | not_available |
| Smiles: | C(c1cccc(c1)[N+]([O-])=O)Oc1cccc(c1)c1nc(c2ccc(cc2)[Cl])on1 |
| Stereo: | ACHIRAL |
| logP: | 6.2119 |
| logD: | 6.2119 |
| logSw: | -6.6715 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.253 |
| InChI Key: | ROKFSEMLNRUAHN-UHFFFAOYSA-N |