N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]-3-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]-3-(trifluoromethyl)benzamide
N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]-3-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V003-1047 |
| Compound Name: | N-(2-{[(4-fluorophenyl)methyl][(thiophen-2-yl)methyl]amino}-2-oxoethyl)-N-[2-(pyrrolidin-1-yl)ethyl]-3-(trifluoromethyl)benzamide |
| Molecular Weight: | 547.61 |
| Molecular Formula: | C28 H29 F4 N3 O2 S |
| Salt: | not_available |
| Smiles: | C1CCN(C1)CCN(CC(N(Cc1ccc(cc1)F)Cc1cccs1)=O)C(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3952 |
| logD: | 3.439 |
| logSw: | -4.3018 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.207 |
| InChI Key: | FKURGPYYNHAOTB-UHFFFAOYSA-N |