Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
TL;DR: Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate (CAS 302913-12-8) is a chemical compound with molecular formula C27H19BrN2O3 and molecular weight 498.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 7-(4-bromobenzoyl)-3-naphthalen-2-ylpyrrolo[1,2-c]pyrimidine-5-carboxylate
Also Known As: Ethyl 7-(4-bromobenzoyl)-3-(naphthalen-2-yl)pyrrolo[1,2-c]pyrimidine-5-carboxylate, ETHYL 7-(4-BROMOBENZOYL)-3-(2-NAPHTHYL)PYRROLO(1,2-C)PYRIMIDINE-5-CARBOXYLATE, ethyl 7-(4-bromobenzoyl)-3-naphthalen-2-ylpyrrolo[1,2-c]pyrimidine-5-carboxylate, 658-639-1, RefChem:595980
| Molecular Formula | C27H19BrN2O3 |
|---|---|
| Molecular Weight | 498.06 g/mol |
| LogP | 6.3247 |
| Topological Polar Surface Area | 60.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 498.05792 |
| Heavy Atoms | 33 |
| Complexity | 1520.288 |
Chemical Identifiers
| CAS Number | 302913-12-8 |
|---|---|
| SMILES | CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=C(C=C3)Br)C4=CC5=CC=CC=C5C=C4 |
Product Overview
Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate (CAS 302913-12-8), with molecular formula C27H19BrN2O3 and molecular weight 498.06 g/mol. IUPAC: ethyl 7-(4-bromobenzoyl)-3-naphthalen-2-ylpyrrolo[1,2-c]pyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
Property Insights of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
The XLogP value of 6.3247 indicates that Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)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-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The CAS number of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is 302913-12-8.
What is the molecular formula of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The molecular formula of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is C27H19BrN2O3.
What is the molecular weight of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The molecular weight of Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is 498.06 g/mol.
Where can I buy Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
You can request a quote for Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)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-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 7-(4-bromobenzoyl)-3-(2-naphthyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.