4-(3,5-dichloroanilino)-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-(3,5-dichloroanilino)-4-oxobut-2-enoic acid
4-(3,5-dichloroanilino)-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | K783-3482 |
| Compound Name: | 4-(3,5-dichloroanilino)-4-oxobut-2-enoic acid |
| Molecular Weight: | 260.07 |
| Molecular Formula: | C10 H7 Cl2 N O3 |
| Smiles: | C(=C\C(Nc1cc(cc(c1)[Cl])[Cl])=O)\C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0645 |
| logD: | -1.3939 |
| logSw: | -3.1353 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.772 |
| InChI Key: | YDCIVHVKWOTWES-UHFFFAOYSA-N |