3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]propanamide
Chemical Structure Depiction of
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]propanamide
3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]propanamide
Compound characteristics
| Compound ID: | S629-0157 |
| Compound Name: | 3-(4-acetyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)-N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]propanamide |
| Molecular Weight: | 398.5 |
| Molecular Formula: | C22 H30 N4 O3 |
| Smiles: | CCN(Cc1cnn(CC)c1)C(CCc1ccc2c(CN(CCO2)C(C)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5642 |
| logD: | 1.5642 |
| logSw: | -1.8836 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.481 |
| InChI Key: | LTEGIYKDPQCGSV-UHFFFAOYSA-N |