5-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-3,6-dimethyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-3,6-dimethyl-1-benzofuran-2-carboxamide
5-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-3,6-dimethyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D335-0084 |
| Compound Name: | 5-chloro-N-{[1-(dimethylamino)cyclohexyl]methyl}-3,6-dimethyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 399.36 |
| Molecular Formula: | C20 H27 Cl N2 O2 |
| Salt: | HCl |
| Smiles: | Cc1cc2c(cc1[Cl])c(C)c(C(NCC1(CCCCC1)N(C)C)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 5.3482 |
| logD: | 4.2759 |
| logSw: | -5.8487 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.763 |
| InChI Key: | NUYNURUSCOBBDD-UHFFFAOYSA-N |