5,7-dimethyl-2-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
Chemical Structure Depiction of
5,7-dimethyl-2-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
5,7-dimethyl-2-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | D491-4248 |
| Compound Name: | 5,7-dimethyl-2-{4-[2-(pyridin-4-yl)ethyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | Cc1cc(C)c2C(C=C(C(N3CCN(CCc4ccncc4)CC3)=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8385 |
| logD: | 2.8223 |
| logSw: | -2.9234 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.652 |
| InChI Key: | KDUQSJVOKHRSOI-UHFFFAOYSA-N |