ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
TL;DR: ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate (CAS 302913-16-2) is a chemical compound with molecular formula C21H15ClN2O3S and molecular weight 410.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-chlorophenyl)-7-(thiophene-2-carbonyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate
Also Known As: ethyl 3-(4-chlorophenyl)-7-(thiophene-2-carbonyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate, ET 3-(4-CL-PHENYL)-7-(2-THIENYLCARBONYL)PYRROLO(1,2-C)PYRIMIDINE-5-CARBOXYLATE, ethyl 3-(4-chlorophenyl)-7-(thiophen-2-ylcarbonyl)pyrrolo[1,2-a]pyrimidine-5-carboxylate, 658-632-3, RefChem:591311
| Molecular Formula | C21H15ClN2O3S |
|---|---|
| Molecular Weight | 410.05 g/mol |
| LogP | 5.1239 |
| Topological Polar Surface Area | 60.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.0492 |
| Heavy Atoms | 28 |
| Complexity | 1164.5642 |
Chemical Identifiers
| CAS Number | 302913-16-2 |
|---|---|
| SMILES | CCOC(=O)C1=C2C=C(N=CN2C(=C1)C(=O)C3=CC=CS3)C4=CC=C(C=C4)Cl |
Product Overview
ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate (CAS 302913-16-2), with molecular formula C21H15ClN2O3S and molecular weight 410.05 g/mol. IUPAC: ethyl 3-(4-chlorophenyl)-7-(thiophene-2-carbonyl)pyrrolo[1,2-c]pyrimidine-5-carboxylate.
Chemical Property Profile of ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
Property Insights of ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate
The XLogP value of 5.1239 indicates that ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)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 ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate. Following Lipinski's Rule of Five, ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate 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 ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The CAS number of ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is 302913-16-2.
What is the molecular formula of ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The molecular formula of ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is C21H15ClN2O3S.
What is the molecular weight of ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
The molecular weight of ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate is 410.05 g/mol.
Where can I buy ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
You can request a quote for ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)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 ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ET 3-(4-CL-Phenyl)-7-(2-thienylcarbonyl)pyrrolo(1,2-C)pyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.