5-chloro-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-chloro-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
5-chloro-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D335-0221 |
| Compound Name: | 5-chloro-N-{[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl}-3-methyl-1-benzofuran-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 454.44 |
| Molecular Formula: | C23 H32 Cl N3 O2 |
| Salt: | HCl |
| Smiles: | CCN1CCN(CC1)C1(CCCCC1)CNC(c1c(C)c2cc(ccc2o1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9192 |
| logD: | 4.6666 |
| logSw: | -4.7137 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.947 |
| InChI Key: | YVGMCGLYENQMHR-UHFFFAOYSA-N |