2-(4-methylphenoxy)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenoxy)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)ethan-1-one
2-(4-methylphenoxy)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | S530-0077 |
| Compound Name: | 2-(4-methylphenoxy)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)ethan-1-one |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C23 H28 N2 O3 |
| Smiles: | Cc1ccc(cc1)OCC(N1Cc2ccccc2OC2(CCN(C)CC2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9326 |
| logD: | 0.6514 |
| logSw: | -3.3051 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.076 |
| InChI Key: | DCQWGQHVDQNMSH-UHFFFAOYSA-N |