2-amino-4-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-amino-4-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y500-9030 |
| Compound Name: | 2-amino-4-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 437.9 |
| Molecular Formula: | C24 H21 Cl F N3 O2 |
| Smiles: | COc1ccc(cc1COc1ccc(c(c1)[Cl])F)c1c2CCCCc2nc(c1C#N)N |
| Stereo: | ACHIRAL |
| logP: | 5.2986 |
| logD: | 5.2958 |
| logSw: | -6.1202 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.615 |
| InChI Key: | QJZWYOQUPMMQNB-UHFFFAOYSA-N |