5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(2-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(2-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(2-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | 5677-0125 |
| Compound Name: | 5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(2-fluorophenoxy)methyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 397.4 |
| Molecular Formula: | C21 H20 F N3 O4 |
| Smiles: | COc1ccc(CCNc2c(C#N)nc(COc3ccccc3F)o2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.0259 |
| logD: | 3.0259 |
| logSw: | -3.2276 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.631 |
| InChI Key: | VZRIPUUFFWSBSB-UHFFFAOYSA-N |