ethyl 4-(3-chloro-4-methoxyanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-chloro-4-methoxyanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
ethyl 4-(3-chloro-4-methoxyanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
Compound characteristics
| Compound ID: | L551-0545 |
| Compound Name: | ethyl 4-(3-chloro-4-methoxyanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate |
| Molecular Weight: | 450.92 |
| Molecular Formula: | C24 H23 Cl N4 O3 |
| Smiles: | CCOC(c1nc(c2c(C)c(C)n(c3ccccc3)c2n1)Nc1ccc(c(c1)[Cl])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7388 |
| logD: | 5.7388 |
| logSw: | -5.9942 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.549 |
| InChI Key: | SZBMHPCCYRPUST-UHFFFAOYSA-N |