3-[1-(4-methylpiperazin-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-[1-(4-methylpiperazin-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
3-[1-(4-methylpiperazin-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-2943 |
| Compound Name: | 3-[1-(4-methylpiperazin-1-yl)-1-oxobutan-2-yl]-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 315.37 |
| Molecular Formula: | C16 H21 N5 O2 |
| Smiles: | CCC(C(N1CCN(C)CC1)=O)N1C(c2ccccc2N=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8274 |
| logD: | 1.6334 |
| logSw: | -2.4539 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.447 |
| InChI Key: | GJULKZIQHVIFCO-AWEZNQCLSA-N |