![1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea structure](/static/products/5979/5979-61-3.webp)
1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
TL;DR: 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea (CAS 5979-61-3) is a chemical compound with molecular formula C31H30Cl2N4O2 and molecular weight 560.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
Also Known As: 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea, N-Butyl-N'-(2,3-dichlorophenyl)-N-{2-[4-(4-methylphenyl)pyrrolo[1,2-a]quinoxalin-5(4H)-yl]-2-oxoethyl}urea
| Molecular Formula | C31H30Cl2N4O2 |
|---|---|
| Molecular Weight | 560.17 g/mol |
| LogP | 7.86272 |
| Topological Polar Surface Area | 57.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 560.17456 |
| Heavy Atoms | 39 |
| Complexity | 1498.727 |
Chemical Identifiers
| CAS Number | 5979-61-3 |
|---|---|
| SMILES | CCCCN(CC(=O)N1C(C2=CC=CN2C3=CC=CC=C31)C4=CC=C(C=C4)C)C(=O)NC5=C(C(=CC=C5)Cl)Cl |
Product Overview
1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea (CAS 5979-61-3), with molecular formula C31H30Cl2N4O2 and molecular weight 560.17 g/mol. IUPAC: 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea.
Chemical Property Profile of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
Property Insights of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea
The XLogP value of 7.86272 indicates that 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.58 Ų, 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea?
The CAS number of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea is 5979-61-3.
What is the molecular formula of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea?
The molecular formula of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea is C31H30Cl2N4O2.
What is the molecular weight of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea?
The molecular weight of 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea is 560.17 g/mol.
Where can I buy 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea?
You can request a quote for 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-butyl-3-(2,3-dichlorophenyl)-1-[2-[4-(4-methylphenyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]-2-oxoethyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.