3-[1-(azepan-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-[1-(azepan-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
3-[1-(azepan-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-2948 |
| Compound Name: | 3-[1-(azepan-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | CCC(C(N1CCCCCC1)=O)N1C(c2ccccc2N=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5052 |
| logD: | 3.5052 |
| logSw: | -3.6895 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.301 |
| InChI Key: | ULZJPSSNZKXQHL-HNNXBMFYSA-N |