2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]butanoic acid
Chemical Structure Depiction of
2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]butanoic acid
2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]butanoic acid
Compound characteristics
| Compound ID: | Y040-8590 |
| Compound Name: | 2-[3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamido]butanoic acid |
| Molecular Weight: | 304.3 |
| Molecular Formula: | C14 H16 N4 O4 |
| Smiles: | CCC(C(O)=O)NC(CCN1C(c2ccccc2N=N1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1046 |
| logD: | -3.5133 |
| logSw: | -2.2279 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.693 |
| InChI Key: | SPJWSHIPSVMOHD-JTQLQIEISA-N |