Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate
TL;DR: Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate (CAS 302912-99-8) is a chemical compound with molecular formula C24H16ClFN2O5 and molecular weight 466.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-(2-chlorophenyl)-7-(4-fluorobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate
Also Known As: dimethyl 3-(2-chlorophenyl)-7-(4-fluorobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate, 5,6-dimethyl 3-(2-chlorophenyl)-7-(4-fluorobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate, Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate, 5,6-dimethyl 3-(2-chlorophenyl)-7-[(4-fluorophenyl)carbonyl]pyrrolo[1,2-a]pyrimidine-5,6-dicarboxylate, 658-671-6
| Molecular Formula | C24H16ClFN2O5 |
|---|---|
| Molecular Weight | 466.07 g/mol |
| LogP | 4.598 |
| Topological Polar Surface Area | 86.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 466.07318 |
| Heavy Atoms | 33 |
| Complexity | 1412.6495 |
Chemical Identifiers
| CAS Number | 302912-99-8 |
|---|---|
| SMILES | COC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OC)C(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4Cl |
Product Overview
Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate (CAS 302912-99-8), with molecular formula C24H16ClFN2O5 and molecular weight 466.07 g/mol. IUPAC: dimethyl 3-(2-chlorophenyl)-7-(4-fluorobenzoyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate.
Chemical Property Profile of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate
Property Insights of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate
The XLogP value of 4.598 indicates that Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
The CAS number of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate is 302912-99-8.
What is the molecular formula of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
The molecular formula of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate is C24H16ClFN2O5.
What is the molecular weight of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
The molecular weight of Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate is 466.07 g/mol.
Where can I buy Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
You can request a quote for Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 3-(2-CL-PH)-7-(4-F-benzoyl)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.