ethyl 4-[5-(3-iodo-5-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[5-(3-iodo-5-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoate
ethyl 4-[5-(3-iodo-5-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoate
Compound characteristics
| Compound ID: | 8013-1419 |
| Compound Name: | ethyl 4-[5-(3-iodo-5-nitrophenyl)-1,3,4-oxadiazol-2-yl]benzoate |
| Molecular Weight: | 465.2 |
| Molecular Formula: | C17 H12 I N3 O5 |
| Smiles: | CCOC(c1ccc(cc1)c1nnc(c2cc(cc(c2)I)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2024 |
| logD: | 5.2024 |
| logSw: | -5.0922 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 84.618 |
| InChI Key: | LFNSORWNYDGDBN-UHFFFAOYSA-N |