6-bromo-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
6-bromo-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
6-bromo-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D335-0230 |
| Compound Name: | 6-bromo-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 498.89 |
| Molecular Formula: | C23 H32 Br N3 O2 |
| Salt: | HCl |
| Smiles: | CCN1CCN(CC1)C1(CCCCC1)CNC(c1c(C)c2ccc(cc2o1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0705 |
| logD: | 4.8179 |
| logSw: | -4.6971 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.947 |
| InChI Key: | DIOHIQBPSIDAOW-UHFFFAOYSA-N |