N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]isoleucine
Chemical Structure Depiction of
N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]isoleucine
N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]isoleucine
Compound characteristics
| Compound ID: | Y042-8809 |
| Compound Name: | N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]isoleucine |
| Molecular Weight: | 318.33 |
| Molecular Formula: | C15 H18 N4 O4 |
| Smiles: | CC[C@@H](C)[C@@H](C(O)=O)NC(CN1C(c2ccccc2N=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.2297 |
| logD: | -3.3995 |
| logSw: | -2.2793 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.436 |
| InChI Key: | OUONDYVBQZANCF-RNCFNFMXSA-N |