3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]propanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]propanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]propanamide
Compound characteristics
| Compound ID: | S629-0875 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]propanamide |
| Molecular Weight: | 410.52 |
| Molecular Formula: | C23 H30 N4 O3 |
| Smiles: | CC(Cn1ccc(C)n1)NC(CCc1ccc2c(CN(CCO2)C(C2CC2)=O)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1027 |
| logD: | 2.1027 |
| logSw: | -2.8418 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.462 |
| InChI Key: | FRDXAPYCIIPVTC-KRWDZBQOSA-N |