4-oxo-4-[(propan-2-yl)amino]but-2-enoic acid
Chemical Structure Depiction of
4-oxo-4-[(propan-2-yl)amino]but-2-enoic acid
4-oxo-4-[(propan-2-yl)amino]but-2-enoic acid
Compound characteristics
| Compound ID: | K781-5535 |
| Compound Name: | 4-oxo-4-[(propan-2-yl)amino]but-2-enoic acid |
| Molecular Weight: | 157.17 |
| Molecular Formula: | C7 H11 N O3 |
| Smiles: | CC(C)NC(/C=C/C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.426 |
| logD: | -3.6192 |
| logSw: | -1.0224 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.34 |
| InChI Key: | HPDQADRQTVTWTP-UHFFFAOYSA-N |