N-(2,2-dimethoxyethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Chemical Structure Depiction of
N-(2,2-dimethoxyethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
N-(2,2-dimethoxyethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
Compound characteristics
Compound ID: | K405-0518 |
Compound Name: | N-(2,2-dimethoxyethyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine |
Molecular Weight: | 442.44 |
Molecular Formula: | C23 H21 F3 N4 O2 |
Smiles: | [H]N(CC(OC)OC)c1c2c(cn(c3cccc(c3)C(F)(F)F)c2ncn1)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 4.7025 |
logD: | 4.5349 |
logSw: | -4.5585 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.467 |
InChI Key: | PPQFCISJZPTJCF-UHFFFAOYSA-N |