![2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide structure](/static/products/579/579441-89-7.png)
2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
TL;DR: 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 579441-89-7) is a chemical compound with molecular formula C23H21ClF3N5O and molecular weight 475.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-(3-methylbutyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
Also Known As: 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-(3-methylbutyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-(3-methylbutyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide
| Molecular Formula | C23H21ClF3N5O |
|---|---|
| Molecular Weight | 475.14 g/mol |
| LogP | 5.604 |
| Topological Polar Surface Area | 85.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.13867 |
| Heavy Atoms | 33 |
| Complexity | 1363.9657 |
Chemical Identifiers
| CAS Number | 579441-89-7 |
|---|---|
| SMILES | CC(C)CCNC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)Cl)C(F)(F)F)N |
Product Overview
2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (CAS 579441-89-7), with molecular formula C23H21ClF3N5O and molecular weight 475.14 g/mol. IUPAC: 2-amino-1-[4-chloro-3-(trifluoromethyl)phenyl]-N-(3-methylbutyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide.
Chemical Property Profile of 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Property Insights of 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
The XLogP value of 5.604 indicates that 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide. Following Lipinski's Rule of Five, 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide has 2 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 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The CAS number of 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 579441-89-7.
What is the molecular formula of 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular formula of 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is C23H21ClF3N5O.
What is the molecular weight of 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
The molecular weight of 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide is 475.14 g/mol.
Where can I buy 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
You can request a quote for 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-1-(4-chloro-3-(trifluoromethyl)phenyl)-N-isopentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.