methyl 3-{[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]carbamoyl}-5-nitrobenzoate
Chemical Structure Depiction of
methyl 3-{[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]carbamoyl}-5-nitrobenzoate
methyl 3-{[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]carbamoyl}-5-nitrobenzoate
Compound characteristics
| Compound ID: | C301-8314 |
| Compound Name: | methyl 3-{[(2-fluorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]carbamoyl}-5-nitrobenzoate |
| Molecular Weight: | 476.42 |
| Molecular Formula: | C24 H17 F N4 O6 |
| Smiles: | COC(c1cc(cc(c1)[N+]([O-])=O)C(NC(c1ccccc1F)c1nnc(c2ccccc2)o1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3419 |
| logD: | 4.2625 |
| logSw: | -4.4971 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.803 |
| InChI Key: | ZQCKPYUKWRUGQG-HXUWFJFHSA-N |