N-{[1-(dimethylamino)cyclohexyl]methyl}-5-fluoro-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-{[1-(dimethylamino)cyclohexyl]methyl}-5-fluoro-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
N-{[1-(dimethylamino)cyclohexyl]methyl}-5-fluoro-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D335-0085 |
| Compound Name: | N-{[1-(dimethylamino)cyclohexyl]methyl}-5-fluoro-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 368.88 |
| Molecular Formula: | C19 H25 F N2 O2 |
| Salt: | HCl |
| Smiles: | Cc1c2cc(ccc2oc1C(NCC1(CCCCC1)N(C)C)=O)F |
| Stereo: | ACHIRAL |
| logP: | 4.0193 |
| logD: | 2.9471 |
| logSw: | -4.0066 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.763 |
| InChI Key: | JTCDLJFFVPLDIA-UHFFFAOYSA-N |