N-[3-(butylamino)-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]-4-chlorobenzamide
Chemical Structure Depiction of
N-[3-(butylamino)-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]-4-chlorobenzamide
N-[3-(butylamino)-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]-4-chlorobenzamide
Compound characteristics
| Compound ID: | Y070-0905 |
| Compound Name: | N-[3-(butylamino)-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]-4-chlorobenzamide |
| Molecular Weight: | 448.95 |
| Molecular Formula: | C26 H25 Cl N2 O3 |
| Smiles: | CCCCNC(/C(=C\c1cccc(c1)Oc1ccccc1)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9341 |
| logD: | 4.2854 |
| logSw: | -6.1759 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.437 |
| InChI Key: | PQAGPEFZDHXHBT-UHFFFAOYSA-N |