N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]-L-glutamic acid
Chemical Structure Depiction of
N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]-L-glutamic acid
N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]-L-glutamic acid
Compound characteristics
| Compound ID: | Y040-8588 |
| Compound Name: | N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]-L-glutamic acid |
| Molecular Weight: | 334.29 |
| Molecular Formula: | C14 H14 N4 O6 |
| Smiles: | C(C[C@@H](C(O)=O)NC(CN1C(c2ccccc2N=N1)=O)=O)C(O)=O |
| Stereo: | ABSOLUTE |
| logP: | -1.3196 |
| logD: | -5.2676 |
| logSw: | -2.2462 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 122.098 |
| InChI Key: | RDUWCBAWUHFGHR-JTQLQIEISA-N |