7-(3-{ethyl[(1-ethyl-1H-pyrazol-4-yl)methyl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-(3-{ethyl[(1-ethyl-1H-pyrazol-4-yl)methyl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-(3-{ethyl[(1-ethyl-1H-pyrazol-4-yl)methyl]amino}-3-oxopropyl)-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S629-0618 |
| Compound Name: | 7-(3-{ethyl[(1-ethyl-1H-pyrazol-4-yl)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: | CCN(Cc1cnn(CC)c1)C(CCc1ccc2c(CN(CCO2)C(NC(C)C)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4201 |
| logD: | 2.4201 |
| logSw: | -2.7546 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.13 |
| InChI Key: | WMEHSWDDHCTVSR-UHFFFAOYSA-N |