N-[(furan-2-yl)methyl]-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
N-[(furan-2-yl)methyl]-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | M249-0096 |
| Compound Name: | N-[(furan-2-yl)methyl]-7-(pyrrolidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C20 H23 N3 O4 |
| Smiles: | C1CCN(C1)C(c1ccc2c(CN(CCO2)C(NCc2ccco2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2477 |
| logD: | 2.2477 |
| logSw: | -2.8554 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.737 |
| InChI Key: | GRHYQJOKKFPWJC-UHFFFAOYSA-N |