2-chloro-N-[2-(cyclohexylamino)-2-oxo-1-(pyridin-4-yl)ethyl]-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-chloro-N-[2-(cyclohexylamino)-2-oxo-1-(pyridin-4-yl)ethyl]-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide
2-chloro-N-[2-(cyclohexylamino)-2-oxo-1-(pyridin-4-yl)ethyl]-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | K784-5108 |
| Compound Name: | 2-chloro-N-[2-(cyclohexylamino)-2-oxo-1-(pyridin-4-yl)ethyl]-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]acetamide |
| Molecular Weight: | 457.96 |
| Molecular Formula: | C24 H28 Cl N3 O4 |
| Smiles: | C1CCC(CC1)NC(C(c1ccncc1)N(CC1COc2ccccc2O1)C(C[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1092 |
| logD: | 3.0971 |
| logSw: | -3.0998 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.153 |
| InChI Key: | PTLWHEUQYMMZBN-UHFFFAOYSA-N |