3-{2-oxo-2-[4-({4-[(piperidin-1-yl)methyl]phenyl}methyl)piperidin-1-yl]ethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-oxo-2-[4-({4-[(piperidin-1-yl)methyl]phenyl}methyl)piperidin-1-yl]ethyl}-1,3-benzoxazol-2(3H)-one
3-{2-oxo-2-[4-({4-[(piperidin-1-yl)methyl]phenyl}methyl)piperidin-1-yl]ethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S722-2461 |
| Compound Name: | 3-{2-oxo-2-[4-({4-[(piperidin-1-yl)methyl]phenyl}methyl)piperidin-1-yl]ethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | C1CCN(CC1)Cc1ccc(CC2CCN(CC2)C(CN2C(=O)Oc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9525 |
| logD: | 1.7678 |
| logSw: | -4.0846 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.921 |
| InChI Key: | HPXUTWKSABRRCQ-UHFFFAOYSA-N |