3-(2-oxo-2-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-oxo-2-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
3-(2-oxo-2-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S723-0762 |
| Compound Name: | 3-(2-oxo-2-{4-[(4-{[(pyridin-4-yl)oxy]methyl}phenyl)methyl]piperidin-1-yl}ethyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | C1CN(CCC1Cc1ccc(COc2ccncc2)cc1)C(CN1C(=O)Oc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5009 |
| logD: | 3.4987 |
| logSw: | -3.5788 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.844 |
| InChI Key: | XKLYHGIIZXRFMJ-UHFFFAOYSA-N |