N-benzyl-N~2~-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-N~2~-butyl-N-[(5-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-benzyl-N~2~-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-N~2~-butyl-N-[(5-methylthiophen-2-yl)methyl]glycinamide
N-benzyl-N~2~-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-N~2~-butyl-N-[(5-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V011-5727 |
| Compound Name: | N-benzyl-N~2~-{[3,5-bis(trifluoromethyl)phenyl]carbamoyl}-N~2~-butyl-N-[(5-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 585.61 |
| Molecular Formula: | C28 H29 F6 N3 O2 S |
| Smiles: | CCCCN(CC(N(Cc1ccccc1)Cc1ccc(C)s1)=O)C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 7.7254 |
| logD: | 7.719 |
| logSw: | -5.6564 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.951 |
| InChI Key: | YMFPWEYHJHBBIS-UHFFFAOYSA-N |