7-methyl-4-{[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-methyl-4-{[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
7-methyl-4-{[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0010 |
| Compound Name: | 7-methyl-4-{[4-(3,4,5-triethoxybenzoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 494.59 |
| Molecular Formula: | C28 H34 N2 O6 |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(N1CCN(CC1)CC1=CC(=O)Oc2cc(C)ccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2831 |
| logD: | 3.2819 |
| logSw: | -3.5686 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.552 |
| InChI Key: | QAMPQJJYKLBBSL-UHFFFAOYSA-N |