3-(4-methoxyphenyl)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)propan-1-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)propan-1-one
3-(4-methoxyphenyl)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)propan-1-one
Compound characteristics
| Compound ID: | S530-0031 |
| Compound Name: | 3-(4-methoxyphenyl)-1-(1'-methyl-3H-spiro[[1,4]benzoxazepine-2,4'-piperidin]-4(5H)-yl)propan-1-one |
| Molecular Weight: | 394.51 |
| Molecular Formula: | C24 H30 N2 O3 |
| Smiles: | CN1CCC2(CC1)CN(Cc1ccccc1O2)C(CCc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2984 |
| logD: | 1.0172 |
| logSw: | -3.6242 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.121 |
| InChI Key: | ULYBFUDQERGXGT-UHFFFAOYSA-N |