5-chloro-3-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-chloro-3-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide
5-chloro-3-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D491-8290 |
| Compound Name: | 5-chloro-3-methyl-N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperazin-1-yl)ethyl]-1-benzofuran-2-carboxamide |
| Molecular Weight: | 452.38 |
| Molecular Formula: | C22 H26 Cl N3 O3 |
| Salt: | HCl |
| Smiles: | [H]N(CC(c1ccc(C)o1)N1CCN(C)CC1)C(c1c(C)c2cc(ccc2o1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8962 |
| logD: | 3.4162 |
| logSw: | -4.2754 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.736 |
| InChI Key: | VFOQCDOTLTUQOX-SFHVURJKSA-N |