2-chloro-N-{4-[(3,5-difluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}pyridine-3-carboxamide
Chemical Structure Depiction of
2-chloro-N-{4-[(3,5-difluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}pyridine-3-carboxamide
2-chloro-N-{4-[(3,5-difluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V017-4524 |
| Compound Name: | 2-chloro-N-{4-[(3,5-difluorophenyl)methyl]-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}pyridine-3-carboxamide |
| Molecular Weight: | 443.84 |
| Molecular Formula: | C22 H16 Cl F2 N3 O3 |
| Salt: | not_available |
| Smiles: | C(c1cc(cc(c1)F)F)N1Cc2cc(ccc2OCC1=O)NC(c1cccnc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9439 |
| logD: | 2.9407 |
| logSw: | -3.7483 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.353 |
| InChI Key: | QONTZEXLMBQWMG-UHFFFAOYSA-N |