N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea
TL;DR: N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea (CAS 478079-13-9) is a chemical compound with molecular formula C15H10BrFN4S and molecular weight 375.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-2-fluorophenyl)-3-quinoxalin-6-ylthiourea
Also Known As: Bionet1_004436, N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea, 3-(4-bromo-2-fluorophenyl)-1-(quinoxalin-6-yl)thiourea, 1-(4-bromo-2-fluorophenyl)-3-quinoxalin-6-ylthiourea, 7R-0649
| Molecular Formula | C15H10BrFN4S |
|---|---|
| Molecular Weight | 375.98 g/mol |
| LogP | 4.3403 |
| Topological Polar Surface Area | 49.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.97937 |
| Heavy Atoms | 22 |
| Complexity | 855.8201 |
Chemical Identifiers
| CAS Number | 478079-13-9 |
|---|---|
| SMILES | C1=CC2=NC=CN=C2C=C1NC(=S)NC3=C(C=C(C=C3)Br)F |
Product Overview
N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea (CAS 478079-13-9), with molecular formula C15H10BrFN4S and molecular weight 375.98 g/mol. IUPAC: 1-(4-bromo-2-fluorophenyl)-3-quinoxalin-6-ylthiourea.
Chemical Property Profile of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea
Property Insights of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea
The XLogP value of 4.3403 indicates that N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.84 Ų, N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea?
The CAS number of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea is 478079-13-9.
What is the molecular formula of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea?
The molecular formula of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea is C15H10BrFN4S.
What is the molecular weight of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea?
The molecular weight of N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea is 375.98 g/mol.
Where can I buy N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea?
You can request a quote for N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromo-2-fluorophenyl)-N'-(6-quinoxalinyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.