4-chloro-7-(3-chlorophenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid
Chemical Structure Depiction of
4-chloro-7-(3-chlorophenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid
4-chloro-7-(3-chlorophenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid
Compound characteristics
| Compound ID: | P160-0038 |
| Compound Name: | 4-chloro-7-(3-chlorophenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-2-carboxylic acid |
| Molecular Weight: | 336.17 |
| Molecular Formula: | C15 H11 Cl2 N3 O2 |
| Smiles: | Cc1c2c(nc(C(O)=O)nc2n(c2cccc(c2)[Cl])c1C)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6472 |
| logD: | -1.6237 |
| logSw: | -3.8228 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.658 |
| InChI Key: | JRAYYOPMNKTIQI-UHFFFAOYSA-N |