7-(3-{[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-(3-{[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-(3-{[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S629-0970 |
| Compound Name: | 7-(3-{[1-(3-methyl-1H-pyrazol-1-yl)propan-2-yl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 427.55 |
| Molecular Formula: | C23 H33 N5 O3 |
| Smiles: | CC(C)NC(N1CCOc2ccc(CCC(NC(C)Cn3ccc(C)n3)=O)cc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2507 |
| logD: | 2.2507 |
| logSw: | -2.8161 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.328 |
| InChI Key: | YLACSLMVEMWJBJ-SFHVURJKSA-N |