6,8-dimethyl-2-{4-[2-(pyridin-2-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
Chemical Structure Depiction of
6,8-dimethyl-2-{4-[2-(pyridin-2-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
6,8-dimethyl-2-{4-[2-(pyridin-2-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | D491-4772 |
| Compound Name: | 6,8-dimethyl-2-{4-[2-(pyridin-2-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | Cc1cc(C)c2c(c1)C(C=C(C(N1CCN(CCc3ccccn3)CC1)=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8874 |
| logD: | 2.8768 |
| logSw: | -3.2838 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.451 |
| InChI Key: | BNODSNDBELGYOO-UHFFFAOYSA-N |