ethyl 4-(4-chloroanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-chloroanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
ethyl 4-(4-chloroanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate
Compound characteristics
| Compound ID: | L551-0456 |
| Compound Name: | ethyl 4-(4-chloroanilino)-5,6-dimethyl-7-phenyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylate |
| Molecular Weight: | 420.9 |
| Molecular Formula: | C23 H21 Cl N4 O2 |
| Smiles: | CCOC(c1nc(c2c(C)c(C)n(c3ccccc3)c2n1)Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8229 |
| logD: | 5.8229 |
| logSw: | -6.0017 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.918 |
| InChI Key: | YCYNCTCUMBZVPJ-UHFFFAOYSA-N |