5-{[(2-chlorophenyl)methyl]amino}-2-ethyl-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(2-chlorophenyl)methyl]amino}-2-ethyl-1,3-oxazole-4-carbonitrile
5-{[(2-chlorophenyl)methyl]amino}-2-ethyl-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-1614 |
| Compound Name: | 5-{[(2-chlorophenyl)methyl]amino}-2-ethyl-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 261.71 |
| Molecular Formula: | C13 H12 Cl N3 O |
| Smiles: | CCc1nc(C#N)c(NCc2ccccc2[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2126 |
| logD: | 3.2126 |
| logSw: | -3.5702 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.215 |
| InChI Key: | QVTHUXTVEOTWLW-UHFFFAOYSA-N |