2-amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y501-5239 |
| Compound Name: | 2-amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 431.96 |
| Molecular Formula: | C26 H26 Cl N3 O |
| Smiles: | Cc1cc(C)c(cc1COc1ccc(cc1C)[Cl])c1c2CCCCc2nc(c1C#N)N |
| Stereo: | ACHIRAL |
| logP: | 7.1372 |
| logD: | 7.1216 |
| logSw: | -6.6075 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.071 |
| InChI Key: | UGSHPRYSNZEWFT-UHFFFAOYSA-N |