2-methoxy-N-[4-(3-methyl-1H-pyrazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]acetamide
Chemical Structure Depiction of
2-methoxy-N-[4-(3-methyl-1H-pyrazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]acetamide
2-methoxy-N-[4-(3-methyl-1H-pyrazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]acetamide
Compound characteristics
| Compound ID: | S555-1236 |
| Compound Name: | 2-methoxy-N-[4-(3-methyl-1H-pyrazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]acetamide |
| Molecular Weight: | 344.37 |
| Molecular Formula: | C17 H20 N4 O4 |
| Smiles: | Cc1cc(C(N2CCOc3ccc(cc3C2)NC(COC)=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 1.0675 |
| logD: | 1.0674 |
| logSw: | -2.2139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.972 |
| InChI Key: | CSPGTZUUURUMSM-UHFFFAOYSA-N |