3,6-dimethyl-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
3,6-dimethyl-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-1-benzofuran-2-carboxamide
3,6-dimethyl-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D335-0179 |
| Compound Name: | 3,6-dimethyl-N-{[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 383.53 |
| Molecular Formula: | C23 H33 N3 O2 |
| Smiles: | Cc1ccc2c(C)c(C(NCC3(CCCCC3)N3CCN(C)CC3)=O)oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3878 |
| logD: | 4.1964 |
| logSw: | -4.3047 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.887 |
| InChI Key: | AJLNVIHIAFEHNA-UHFFFAOYSA-N |