3-[2-oxo-2-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidin-1-yl)ethyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-[2-oxo-2-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidin-1-yl)ethyl]-1,3-benzoxazol-2(3H)-one
3-[2-oxo-2-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidin-1-yl)ethyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S690-0658 |
| Compound Name: | 3-[2-oxo-2-(4-{[4-(pyrrolidine-1-carbonyl)phenyl]methyl}piperidin-1-yl)ethyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C26 H29 N3 O4 |
| Smiles: | C1CCN(C1)C(c1ccc(CC2CCN(CC2)C(CN2C(=O)Oc3ccccc23)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1285 |
| logD: | 3.1285 |
| logSw: | -3.4788 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.202 |
| InChI Key: | ZADWQDLRYFJDBO-UHFFFAOYSA-N |