4-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
4-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
4-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0199 |
| Compound Name: | 4-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 408.47 |
| Molecular Formula: | C23 H25 F N4 O2 |
| Smiles: | Cc1c(CN2CCOc3ccc(cc3C2)C(NCc2ccccc2F)=O)cnn1C |
| Stereo: | ACHIRAL |
| logP: | 2.8516 |
| logD: | -0.3062 |
| logSw: | -3.1877 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.815 |
| InChI Key: | DYTGFAMANKWWRC-UHFFFAOYSA-N |