7-methyl-4-{[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-methyl-4-{[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
7-methyl-4-{[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0110 |
| Compound Name: | 7-methyl-4-{[4-(2-oxo-2H-1-benzopyran-3-carbonyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C25 H22 N2 O5 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)C(C3=Cc4ccccc4OC3=O)=O)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5953 |
| logD: | 2.5937 |
| logSw: | -3.167 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.756 |
| InChI Key: | LFBSCWAXUJZEHI-UHFFFAOYSA-N |