2-amino-4-{5-[(3-bromophenoxy)methyl]furan-2-yl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-{5-[(3-bromophenoxy)methyl]furan-2-yl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-amino-4-{5-[(3-bromophenoxy)methyl]furan-2-yl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y500-8354 |
| Compound Name: | 2-amino-4-{5-[(3-bromophenoxy)methyl]furan-2-yl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 424.3 |
| Molecular Formula: | C21 H18 Br N3 O2 |
| Smiles: | C1CCc2c(C1)c(c(C#N)c(N)n2)c1ccc(COc2cccc(c2)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 5.0413 |
| logD: | 5.04 |
| logSw: | -5.1185 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.826 |
| InChI Key: | SKHPGLDOKOLQIT-UHFFFAOYSA-N |