N-[1-(3-chloro-4-fluoroanilino)-4-(methylsulfanyl)-1-oxobutan-2-yl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[1-(3-chloro-4-fluoroanilino)-4-(methylsulfanyl)-1-oxobutan-2-yl]cyclohexanecarboxamide
N-[1-(3-chloro-4-fluoroanilino)-4-(methylsulfanyl)-1-oxobutan-2-yl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | C155-0267 |
| Compound Name: | N-[1-(3-chloro-4-fluoroanilino)-4-(methylsulfanyl)-1-oxobutan-2-yl]cyclohexanecarboxamide |
| Molecular Weight: | 386.91 |
| Molecular Formula: | C18 H24 Cl F N2 O2 S |
| Smiles: | CSCCC(C(Nc1ccc(c(c1)[Cl])F)=O)NC(C1CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3363 |
| logD: | 4.3146 |
| logSw: | -4.4348 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.837 |
| InChI Key: | NSBRUCWGHNSSDP-INIZCTEOSA-N |