Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate
TL;DR: Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate (CAS 618070-09-0) is a chemical compound with molecular formula C25H20BrNO5 and molecular weight 493.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 3-(4-bromobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate
Also Known As: SALOR-INT L172790-1EA, J2.805.441F, diethyl 3-(4-bromobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate, Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate, 1,2-diethyl 3-(4-bromobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate
| Molecular Formula | C25H20BrNO5 |
|---|---|
| Molecular Weight | 493.05 g/mol |
| LogP | 5.4394 |
| Topological Polar Surface Area | 74.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.0525 |
| Heavy Atoms | 32 |
| Complexity | 1354.5331 |
Chemical Identifiers
| CAS Number | 618070-09-0 |
|---|---|
| SMILES | CCOC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1C(=O)OCC)C(=O)C4=CC=C(C=C4)Br |
Product Overview
Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate (CAS 618070-09-0), with molecular formula C25H20BrNO5 and molecular weight 493.05 g/mol. IUPAC: diethyl 3-(4-bromobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate.
Chemical Property Profile of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate
Property Insights of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate
The XLogP value of 5.4394 indicates that Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate?
The CAS number of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate is 618070-09-0.
What is the molecular formula of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate?
The molecular formula of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate is C25H20BrNO5.
What is the molecular weight of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate?
The molecular weight of Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate is 493.05 g/mol.
Where can I buy Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate?
You can request a quote for Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 3-(4-bromobenzoyl)pyrrolo(2,1-A)isoquinoline-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.