2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-(4-cyclohexylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-(4-cyclohexylpiperazin-1-yl)ethan-1-one
2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-(4-cyclohexylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | E613-0232 |
| Compound Name: | 2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}-1-(4-cyclohexylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C23 H29 N3 O5 |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(COCc1cc(c2ccc3c(c2)OCO3)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0001 |
| logD: | 2.7419 |
| logSw: | -3.0939 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.033 |
| InChI Key: | LFIWJJPXCAQXRN-UHFFFAOYSA-N |