N~1~,N~1~-dimethyl-N~3~-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}propane-1,3-diamine
Chemical Structure Depiction of
N~1~,N~1~-dimethyl-N~3~-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}propane-1,3-diamine
N~1~,N~1~-dimethyl-N~3~-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}propane-1,3-diamine
Compound characteristics
| Compound ID: | K405-0527 |
| Compound Name: | N~1~,N~1~-dimethyl-N~3~-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}propane-1,3-diamine |
| Molecular Weight: | 439.48 |
| Molecular Formula: | C24 H24 F3 N5 |
| Smiles: | [H]N(CCCN(C)C)c1c2c(cn(c3cccc(c3)C(F)(F)F)c2ncn1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1147 |
| logD: | 3.179 |
| logSw: | -5.1654 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.68 |
| InChI Key: | HOYNRYNNFWKOEM-UHFFFAOYSA-N |