(2S)-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamido](phenyl)acetic acid
Chemical Structure Depiction of
(2S)-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamido](phenyl)acetic acid
(2S)-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamido](phenyl)acetic acid
Compound characteristics
| Compound ID: | Y040-8604 |
| Compound Name: | (2S)-[4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamido](phenyl)acetic acid |
| Molecular Weight: | 366.37 |
| Molecular Formula: | C19 H18 N4 O4 |
| Smiles: | C(CC(N[C@H](C(O)=O)c1ccccc1)=O)CN1C(c2ccccc2N=N1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.8095 |
| logD: | -3.0649 |
| logSw: | -2.1316 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.143 |
| InChI Key: | QZIPLMGZYHUZDC-QGZVFWFLSA-N |