N-(3-chloro-4-methoxyphenyl)-4-[(4-ethylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-4-[(4-ethylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
N-(3-chloro-4-methoxyphenyl)-4-[(4-ethylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
Compound characteristics
| Compound ID: | D089-0495 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-4-[(4-ethylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide |
| Molecular Weight: | 457.96 |
| Molecular Formula: | C24 H28 Cl N3 O4 |
| Smiles: | CCN1CCN(CC1)Cc1c(ccc2c1c(C(Nc1ccc(c(c1)[Cl])OC)=O)c(C)o2)O |
| Stereo: | ACHIRAL |
| logP: | 3.8746 |
| logD: | 2.9429 |
| logSw: | -4.2113 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.725 |
| InChI Key: | XHVIFIAEPGYHBH-UHFFFAOYSA-N |