6-bromo-N-{[1-(dimethylamino)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
6-bromo-N-{[1-(dimethylamino)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide
6-bromo-N-{[1-(dimethylamino)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
Compound ID: | D335-0090 |
Compound Name: | 6-bromo-N-{[1-(dimethylamino)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide |
Molecular Weight: | 429.78 |
Molecular Formula: | C19 H25 Br N2 O2 |
Salt: | HCl |
Smiles: | Cc1c2ccc(cc2oc1C(NCC1(CCCCC1)N(C)C)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 4.7822 |
logD: | 3.71 |
logSw: | -4.5774 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 35.763 |
InChI Key: | FHRVCRBFNBYPAF-UHFFFAOYSA-N |