6-methoxy-4-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-methoxy-4-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-methoxy-4-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0133 |
| Compound Name: | 6-methoxy-4-{[4-(2-phenylbutanoyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C25 H28 N2 O4 |
| Smiles: | CCC(C(N1CCN(CC1)CC1=CC(=O)Oc2ccc(cc12)OC)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2908 |
| logD: | 3.2887 |
| logSw: | -3.8095 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.378 |
| InChI Key: | JINFRMXFLZTSLH-OAQYLSRUSA-N |