N-[(2RS)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)pentanoyl]glycine
Chemical Structure Depiction of
N-[(2RS)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)pentanoyl]glycine
N-[(2RS)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)pentanoyl]glycine
Compound characteristics
| Compound ID: | Y042-8835 |
| Compound Name: | N-[(2RS)-3-methyl-2-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)pentanoyl]glycine |
| Molecular Weight: | 318.33 |
| Molecular Formula: | C15 H18 N4 O4 |
| Smiles: | CC[C@@H](C)[C@@H](C(NCC(O)=O)=O)N1C(c2ccccc2N=N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.069 |
| logD: | -2.8593 |
| logSw: | -2.2042 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.426 |
| InChI Key: | OIGBDNGJCXKHLN-RNCFNFMXSA-N |