3-{(2S)-1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-{(2S)-1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one
3-{(2S)-1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | Y041-4938 |
| Compound Name: | 3-{(2S)-1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 364.41 |
| Molecular Formula: | C19 H20 N6 O2 |
| Smiles: | C[C@@H](C(N1CCN(CC1)c1ccccn1)=O)N1C(c2ccccc2N=N1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6774 |
| logD: | 2.6685 |
| logSw: | -3.2792 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.157 |
| InChI Key: | FOEQKEKGMNNFCJ-AWEZNQCLSA-N |