7-[3-(4-acetylpiperazin-1-yl)-2-hydroxypropoxy]-3-benzyl-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[3-(4-acetylpiperazin-1-yl)-2-hydroxypropoxy]-3-benzyl-4-methyl-2H-1-benzopyran-2-one
7-[3-(4-acetylpiperazin-1-yl)-2-hydroxypropoxy]-3-benzyl-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-4521 |
| Compound Name: | 7-[3-(4-acetylpiperazin-1-yl)-2-hydroxypropoxy]-3-benzyl-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 450.53 |
| Molecular Formula: | C26 H30 N2 O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(ccc12)OCC(CN1CCN(CC1)C(C)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8991 |
| logD: | 2.8882 |
| logSw: | -3.3723 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.935 |
| InChI Key: | POIDGLBSTHSDRW-NRFANRHFSA-N |