N~4~-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-N~1~,N~1~-dimethylbenzene-1,4-diamine
Chemical Structure Depiction of
N~4~-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-N~1~,N~1~-dimethylbenzene-1,4-diamine
N~4~-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-N~1~,N~1~-dimethylbenzene-1,4-diamine
Compound characteristics
| Compound ID: | K405-0973 |
| Compound Name: | N~4~-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-N~1~,N~1~-dimethylbenzene-1,4-diamine |
| Molecular Weight: | 453.97 |
| Molecular Formula: | C27 H24 Cl N5 |
| Smiles: | [H]N(c1ccc(cc1)N(C)C)c1c2c(cn(c3ccc(C)c(c3)[Cl])c2ncn1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.268 |
| logD: | 7.257 |
| logSw: | -6.7848 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.184 |
| InChI Key: | YBEFJBXVDQKRRK-UHFFFAOYSA-N |