N-[2-(azepan-1-yl)ethyl]-2-[3-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-[3-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide
N-[2-(azepan-1-yl)ethyl]-2-[3-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide
Compound characteristics
| Compound ID: | CM4207-1690 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-[3-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-7-yl]acetamide |
| Molecular Weight: | 403.57 |
| Molecular Formula: | C22 H37 N5 O2 |
| Smiles: | C1CCCN(CC1)CCNC(CC1CCc2nnc(C3CCOCC3)n2CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7757 |
| logD: | 0.0769 |
| logSw: | -2.0068 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.718 |
| InChI Key: | GWAKCXCEILYUNO-SFHVURJKSA-N |