Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
TL;DR: Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate (CAS 302912-53-4) is a chemical compound with molecular formula C23H17FN2O3 and molecular weight 388.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate
Also Known As: ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate, Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate, ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo[1,2-a]pyrimidine-5-carboxylate, 658-779-3, Ethyl 9-benzoyl-4-(4-fluorophenyl)-1,3-diazabicyclo[4.3.0]nona-2,4,6,8-tetraene-7-carboxylate
| Molecular Formula | C23H17FN2O3 |
|---|---|
| Molecular Weight | 388.12 g/mol |
| LogP | 4.5481 |
| Topological Polar Surface Area | 60.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.1223 |
| Heavy Atoms | 29 |
| Complexity | 1198.2653 |
Chemical Identifiers
| CAS Number | 302912-53-4 |
|---|---|
| SMILES | CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)F |
Product Overview
Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate (CAS 302912-53-4), with molecular formula C23H17FN2O3 and molecular weight 388.12 g/mol. IUPAC: ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
Property Insights of Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
The XLogP value of 4.5481 indicates that Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate has 0 hydrogen bond donor(s) and 4 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 Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The CAS number of Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is 302912-53-4.
What is the molecular formula of Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The molecular formula of Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is C23H17FN2O3.
What is the molecular weight of Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The molecular weight of Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is 388.12 g/mol.
Where can I buy Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
You can request a quote for Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 7-benzoyl-3-(4-fluorophenyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.