N-benzyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
N-benzyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0282 |
| Compound Name: | N-benzyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C24 H25 N3 O4 |
| Smiles: | Cc1c(CC(N2CCOc3ccc(cc3C2)C(NCc2ccccc2)=O)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.9203 |
| logD: | 2.9203 |
| logSw: | -3.4562 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.755 |
| InChI Key: | ZOLRJJOOMMBJCC-UHFFFAOYSA-N |