3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | S629-0251 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide |
| Molecular Weight: | 382.46 |
| Molecular Formula: | C22 H26 N2 O4 |
| Smiles: | Cc1ccc(CNC(CCc2ccc3c(CN(CCO3)C(C3CC3)=O)c2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.243 |
| logD: | 3.243 |
| logSw: | -3.251 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.817 |
| InChI Key: | IMHQHOPRSLBERT-UHFFFAOYSA-N |