7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0013 |
| Compound Name: | 7-methyl-4-({4-[2-(pyridin-4-yl)quinoline-4-carbonyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 490.56 |
| Molecular Formula: | C30 H26 N4 O3 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)C(c3cc(c4ccncc4)nc4ccccc34)=O)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0397 |
| logD: | 4.0385 |
| logSw: | -4.1175 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.322 |
| InChI Key: | XQSZRQISGOHGNZ-UHFFFAOYSA-N |