6-chloro-3,4-dimethyl-7-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethoxy)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-3,4-dimethyl-7-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethoxy)-2H-1-benzopyran-2-one
6-chloro-3,4-dimethyl-7-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethoxy)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-6924 |
| Compound Name: | 6-chloro-3,4-dimethyl-7-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethoxy)-2H-1-benzopyran-2-one |
| Molecular Weight: | 455.94 |
| Molecular Formula: | C24 H26 Cl N3 O4 |
| Smiles: | CC1=C(C)c2cc(c(cc2OC1=O)OCC(N1CCN(CCc2ccccn2)CC1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.8953 |
| logD: | 2.8594 |
| logSw: | -3.5695 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.929 |
| InChI Key: | MOXSXKIKAZMGMH-UHFFFAOYSA-N |