7-methyl-2-{4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
Chemical Structure Depiction of
7-methyl-2-{4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
7-methyl-2-{4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | D653-0108 |
| Compound Name: | 7-methyl-2-{4-[(pyridin-4-yl)methyl]piperazine-1-carbonyl}-4H-1-benzopyran-4-one |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C21 H21 N3 O3 |
| Smiles: | Cc1ccc2C(C=C(C(N3CCN(CC3)Cc3ccncc3)=O)Oc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9399 |
| logD: | 1.9154 |
| logSw: | -2.5878 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.674 |
| InChI Key: | CXKZLMBOPLNPCH-UHFFFAOYSA-N |