4-{[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetyl}piperazin-2-one
Chemical Structure Depiction of
4-{[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetyl}piperazin-2-one
4-{[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetyl}piperazin-2-one
Compound characteristics
| Compound ID: | Y040-5675 |
| Compound Name: | 4-{[(3-benzyl-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetyl}piperazin-2-one |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C24 H24 N2 O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(C)cc(c12)OCC(N1CCNC(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3906 |
| logD: | 2.3906 |
| logSw: | -2.9675 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.552 |
| InChI Key: | QDTKQIHXSWCZHI-UHFFFAOYSA-N |