4-butyl-N-[1-(4-fluorophenyl)-3-(3-methylanilino)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-butyl-N-[1-(4-fluorophenyl)-3-(3-methylanilino)-3-oxoprop-1-en-2-yl]benzamide
4-butyl-N-[1-(4-fluorophenyl)-3-(3-methylanilino)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2447-3009 |
| Compound Name: | 4-butyl-N-[1-(4-fluorophenyl)-3-(3-methylanilino)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C27 H27 F N2 O2 |
| Smiles: | CCCCc1ccc(cc1)C(NC(=C/c1ccc(cc1)F)\C(Nc1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6335 |
| logD: | 6.4955 |
| logSw: | -5.6513 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.254 |
| InChI Key: | MGCOUIBSSGKMGW-UHFFFAOYSA-N |