4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0200 |
| Compound Name: | 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[(2-fluorophenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C23 H24 F N3 O3 |
| Smiles: | Cc1c(CN2CCOc3ccc(cc3C2)C(NCc2ccccc2F)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.4834 |
| logD: | 2.4267 |
| logSw: | -3.7523 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.367 |
| InChI Key: | UZXMTQWSQDPITL-UHFFFAOYSA-N |