N~1~,N~4~-bis[3-(butylsulfanyl)propyl]-2-[(3,4-dimethoxyphenyl)(hydroxy)methyl]butanediamide
Chemical Structure Depiction of
N~1~,N~4~-bis[3-(butylsulfanyl)propyl]-2-[(3,4-dimethoxyphenyl)(hydroxy)methyl]butanediamide
N~1~,N~4~-bis[3-(butylsulfanyl)propyl]-2-[(3,4-dimethoxyphenyl)(hydroxy)methyl]butanediamide
Compound characteristics
| Compound ID: | C700-0760 |
| Compound Name: | N~1~,N~4~-bis[3-(butylsulfanyl)propyl]-2-[(3,4-dimethoxyphenyl)(hydroxy)methyl]butanediamide |
| Molecular Weight: | 542.8 |
| Molecular Formula: | C27 H46 N2 O5 S2 |
| Smiles: | CCCCSCCCNC(CC(C(c1ccc(c(c1)OC)OC)O)C(NCCCSCCCC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0638 |
| logD: | 3.0638 |
| logSw: | -3.1587 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.023 |
| InChI Key: | DZILUJUTACENRL-UHFFFAOYSA-N |