Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate
TL;DR: Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate (CAS 618070-16-9) is a chemical compound with molecular formula C27H23BrN2O5 and molecular weight 534.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 7-(4-bromobenzoyl)-3-(4-methylphenyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate
Also Known As: Diethyl 7-(4-bromobenzoyl)-3-(p-tolyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate, 5,6-diethyl 7-(4-bromobenzoyl)-3-(4-methylphenyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate, diethyl 7-(4-bromobenzoyl)-3-(4-methylphenyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate, Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate, 632-794-5
| Molecular Formula | C27H23BrN2O5 |
|---|---|
| Molecular Weight | 534.08 g/mol |
| LogP | 5.65662 |
| Topological Polar Surface Area | 86.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 534.07904 |
| Heavy Atoms | 35 |
| Complexity | 1422.9865 |
Chemical Identifiers
| CAS Number | 618070-16-9 |
|---|---|
| SMILES | CCOC(=O)C1=C2C=C(N=CN2C(=C1C(=O)OCC)C(=O)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)C |
Product Overview
Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate (CAS 618070-16-9), with molecular formula C27H23BrN2O5 and molecular weight 534.08 g/mol. IUPAC: diethyl 7-(4-bromobenzoyl)-3-(4-methylphenyl)pyrrolo[1,2-c]pyrimidine-5,6-dicarboxylate.
Chemical Property Profile of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate
Property Insights of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate
The XLogP value of 5.65662 indicates that Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)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 Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
The CAS number of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate is 618070-16-9.
What is the molecular formula of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
The molecular formula of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate is C27H23BrN2O5.
What is the molecular weight of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
The molecular weight of Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate is 534.08 g/mol.
Where can I buy Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
You can request a quote for Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)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 Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 7-(4-bromobenzoyl)-3-(4-ME-PH)pyrrolo(1,2-C)pyrimidine-5,6-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.