N-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoyl]-L-phenylalanine
Chemical Structure Depiction of
N-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoyl]-L-phenylalanine
N-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoyl]-L-phenylalanine
Compound characteristics
| Compound ID: | Y040-8605 |
| Compound Name: | N-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoyl]-L-phenylalanine |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C20 H20 N4 O4 |
| Smiles: | C(CC(N[C@@H](Cc1ccccc1)C(O)=O)=O)CN1C(c2ccccc2N=N1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.7318 |
| logD: | -2.8588 |
| logSw: | -2.0378 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.421 |
| InChI Key: | USTHFXAQZOKGKB-KRWDZBQOSA-N |