N-[(3-fluorophenyl)methyl]-N-{4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}-3-methylbutanamide
Chemical Structure Depiction of
N-[(3-fluorophenyl)methyl]-N-{4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}-3-methylbutanamide
N-[(3-fluorophenyl)methyl]-N-{4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}-3-methylbutanamide
Compound characteristics
| Compound ID: | V023-4478 |
| Compound Name: | N-[(3-fluorophenyl)methyl]-N-{4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl}-3-methylbutanamide |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C27 H29 F N2 O3 |
| Smiles: | CC(C)CC(N(Cc1cccc(c1)F)c1ccc(CC(Nc2ccc(cc2)OC)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4364 |
| logD: | 5.4364 |
| logSw: | -5.3613 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.755 |
| InChI Key: | RXYLRHCTARQFFS-UHFFFAOYSA-N |