3-[4-(pyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
3-[4-(pyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
3-[4-(pyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1410 |
| Compound Name: | 3-[4-(pyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 325.37 |
| Molecular Formula: | C18 H19 N3 O3 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(c2cccnc2)=O)c1)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6366 |
| logD: | 0.6365 |
| logSw: | -1.0728 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.737 |
| InChI Key: | HRTNWSSRQQILDI-UHFFFAOYSA-N |