N-{4-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
Chemical Structure Depiction of
N-{4-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
N-{4-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide
Compound characteristics
| Compound ID: | S555-1561 |
| Compound Name: | N-{4-[(3,5-dimethyl-1H-pyrazol-1-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}cyclopropanecarboxamide |
| Molecular Weight: | 368.43 |
| Molecular Formula: | C20 H24 N4 O3 |
| Smiles: | Cc1cc(C)n(CC(N2CCOc3ccc(cc3C2)NC(C2CC2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.3386 |
| logD: | 1.3386 |
| logSw: | -2.1989 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.925 |
| InChI Key: | LDOWWELHGMKJDW-UHFFFAOYSA-N |