N-{[4-(dimethylamino)phenyl]methyl}-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | G121-0254 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-5-(pyrido[2,3-b][1,4]benzoxazepin-5(6H)-yl)thiophene-2-carboxamide |
| Molecular Weight: | 456.57 |
| Molecular Formula: | C26 H24 N4 O2 S |
| Smiles: | CN(C)c1ccc(CNC(c2ccc(N3Cc4ccccc4Oc4c3cccn4)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3805 |
| logD: | 5.3651 |
| logSw: | -5.3449 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.068 |
| InChI Key: | ASNJJASAMFOIJM-UHFFFAOYSA-N |