5-chloro-3,6-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-chloro-3,6-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
5-chloro-3,6-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D491-8293 |
| Compound Name: | 5-chloro-3,6-dimethyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide--hydrogen chloride (1/1) |
| Molecular Weight: | 466.41 |
| Molecular Formula: | C23 H28 Cl N3 O3 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(C)o1)N1CCN(C)CC1)C(c1c(C)c2cc(c(C)cc2o1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6134 |
| logD: | 4.1334 |
| logSw: | -4.6308 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.736 |
| InChI Key: | UCQZXMYIOYLLIQ-IBGZPJMESA-N |