3-(2-chloro-5-methylanilino)-1-(pyridin-3-yl)but-2-en-1-one
Chemical Structure Depiction of
3-(2-chloro-5-methylanilino)-1-(pyridin-3-yl)but-2-en-1-one
3-(2-chloro-5-methylanilino)-1-(pyridin-3-yl)but-2-en-1-one
Compound characteristics
| Compound ID: | 8009-3583 |
| Compound Name: | 3-(2-chloro-5-methylanilino)-1-(pyridin-3-yl)but-2-en-1-one |
| Molecular Weight: | 286.76 |
| Molecular Formula: | C16 H15 Cl N2 O |
| Smiles: | C/C(=C\C(c1cccnc1)=O)Nc1cc(C)ccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2517 |
| logD: | 3.2508 |
| logSw: | -3.5455 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.8622 |
| InChI Key: | YDHBDYATJZEVRP-UHFFFAOYSA-N |