3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[2-(pyridin-3-yl)ethyl]propanamide
Chemical Structure Depiction of
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[2-(pyridin-3-yl)ethyl]propanamide
3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[2-(pyridin-3-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | S629-0262 |
| Compound Name: | 3-[4-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-[2-(pyridin-3-yl)ethyl]propanamide |
| Molecular Weight: | 393.48 |
| Molecular Formula: | C23 H27 N3 O3 |
| Smiles: | C(Cc1ccc2c(CN(CCO2)C(C2CC2)=O)c1)C(NCCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5073 |
| logD: | 1.5056 |
| logSw: | -1.6685 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.913 |
| InChI Key: | ZQSCZDISBPTWEJ-UHFFFAOYSA-N |