1-[4-(methylsulfanyl)phenyl]-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine--oxalic acid (1/1)
Chemical Structure Depiction of
1-[4-(methylsulfanyl)phenyl]-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine--oxalic acid (1/1)
1-[4-(methylsulfanyl)phenyl]-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3702-1461 |
| Compound Name: | 1-[4-(methylsulfanyl)phenyl]-N-[(3,4,5-trimethoxyphenyl)methyl]methanamine--oxalic acid (1/1) |
| Molecular Weight: | 423.48 |
| Molecular Formula: | C18 H23 N O3 S |
| Salt: | HOOCCOOH |
| Smiles: | COc1cc(CNCc2ccc(cc2)SC)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3604 |
| logD: | -0.2835 |
| logSw: | -3.5642 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.982 |
| InChI Key: | IZTZTRUHYZXVKF-UHFFFAOYSA-N |