1-(2,3-dimethoxyphenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}methanamine
Chemical Structure Depiction of
1-(2,3-dimethoxyphenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}methanamine
1-(2,3-dimethoxyphenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}methanamine
Compound characteristics
| Compound ID: | Y501-7022 |
| Compound Name: | 1-(2,3-dimethoxyphenyl)-N-{[4-(methylsulfanyl)phenyl]methyl}methanamine |
| Molecular Weight: | 303.42 |
| Molecular Formula: | C17 H21 N O2 S |
| Smiles: | COc1cccc(CNCc2ccc(cc2)SC)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.6851 |
| logD: | 1.2011 |
| logSw: | -4.0061 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.3517 |
| InChI Key: | CDUPTXNAHOCCGC-UHFFFAOYSA-N |