3-(2-oxo-2-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-oxo-2-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
3-(2-oxo-2-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | T505-0107 |
| Compound Name: | 3-(2-oxo-2-{2-[2-(4-phenyl-1H-1,2,3-triazol-1-yl)ethyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C24 H25 N5 O3 |
| Smiles: | C1CCN(C(C1)CCn1cc(c2ccccc2)nn1)C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2795 |
| logD: | 3.2795 |
| logSw: | -3.5278 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.326 |
| InChI Key: | JUBNUWZUJXEQIR-LJQANCHMSA-N |