2-{[4-(5-tert-butyl-2-methylfuran-3-carbonyl)piperazin-1-yl]methyl}-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one
Chemical Structure Depiction of
2-{[4-(5-tert-butyl-2-methylfuran-3-carbonyl)piperazin-1-yl]methyl}-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one
2-{[4-(5-tert-butyl-2-methylfuran-3-carbonyl)piperazin-1-yl]methyl}-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one
Compound characteristics
| Compound ID: | V001-4668 |
| Compound Name: | 2-{[4-(5-tert-butyl-2-methylfuran-3-carbonyl)piperazin-1-yl]methyl}-5-[(3,5-dimethylphenyl)methoxy]-4H-pyran-4-one |
| Molecular Weight: | 492.62 |
| Molecular Formula: | C29 H36 N2 O5 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(COC2=COC(CN3CCN(CC3)C(c3cc(C(C)(C)C)oc3C)=O)=CC2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8341 |
| logD: | 4.8338 |
| logSw: | -4.6426 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.665 |
| InChI Key: | GBLJGQVFIKFFOY-UHFFFAOYSA-N |