ethyl 4-(3-chloroanilino)-5,6-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-chloroanilino)-5,6-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
ethyl 4-(3-chloroanilino)-5,6-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
Compound characteristics
Compound ID: | L551-1001 |
Compound Name: | ethyl 4-(3-chloroanilino)-5,6-dimethyl-7-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate |
Molecular Weight: | 434.92 |
Molecular Formula: | C24 H23 Cl N4 O2 |
Smiles: | CCOC(c1nc(c2c(C)c(C)n(c3ccc(C)cc3)c2n1)Nc1cccc(c1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 6.5267 |
logD: | 6.5267 |
logSw: | -6.3258 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.918 |
InChI Key: | GPOCCSNWKKICBK-UHFFFAOYSA-N |