3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3-benzotriazin-4(3H)-one
3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-9770 |
| Compound Name: | 3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C21 H23 N5 O2 |
| Smiles: | C(CC(N1CCN(CC1)c1ccccc1)=O)CN1C(c2ccccc2N=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2197 |
| logD: | 2.2196 |
| logSw: | -2.8373 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.564 |
| InChI Key: | WMCIFCOVADPAGR-UHFFFAOYSA-N |