7-(3-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl](methyl)amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-(3-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl](methyl)amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-(3-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl](methyl)amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S629-0615 |
| Compound Name: | 7-(3-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl](methyl)amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C24 H35 N5 O3 |
| Smiles: | CCn1cc(CN(C)C(CCc2ccc3c(CN(CCO3)C(NC(C)C)=O)c2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.597 |
| logD: | 2.597 |
| logSw: | -2.8366 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.698 |
| InChI Key: | HVKONZOQCMNNQS-UHFFFAOYSA-N |