N,N'-[methylenebis(2-methyl-4,1-phenylene)]bis{1-[4-(phenylethynyl)phenyl]methanimine}
Chemical Structure Depiction of
N,N'-[methylenebis(2-methyl-4,1-phenylene)]bis{1-[4-(phenylethynyl)phenyl]methanimine}
N,N'-[methylenebis(2-methyl-4,1-phenylene)]bis{1-[4-(phenylethynyl)phenyl]methanimine}
Compound characteristics
| Compound ID: | 8005-0431 |
| Compound Name: | N,N'-[methylenebis(2-methyl-4,1-phenylene)]bis{1-[4-(phenylethynyl)phenyl]methanimine} |
| Molecular Weight: | 602.78 |
| Molecular Formula: | C45 H34 N2 |
| Smiles: | Cc1cc(Cc2ccc(c(C)c2)/N=C/c2ccc(C#Cc3ccccc3)cc2)ccc1/N=C/c1ccc(C#Cc2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 12.4551 |
| logD: | 12.4544 |
| logSw: | -5.9546 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 14.283 |
| InChI Key: | SWQZXKQRPNEERV-UHFFFAOYSA-N |