8H-010
TL;DR: 8H-010 (CAS 339096-85-4) is a chemical compound with molecular formula C17H12Cl2F3N5OS and molecular weight 461.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-3-methylimidazol-4-yl]urea
Also Known As: 8H-010, N-(4-Chlorophenyl)-N'-(2-((3-chloro-5-(trifluoromethyl)-2-pyridinyl)sulfanyl)-1-methyl-1H-imidazol-5-yl)urea, 1-(4-chlorophenyl)-3-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-3-methylimidazol-4-yl]urea, 3-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}-1-methyl-1H-imidazol-5-yl)-1-(4-chlorophenyl)urea, 3-(2-{[3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDIN-2-YL]SULFANYL}-3-METHYLIMIDAZOL-4-YL)-1-(4-CHLOROPHENYL)UREA
| Molecular Formula | C17H12Cl2F3N5OS |
|---|---|
| Molecular Weight | 461.01 g/mol |
| LogP | 5.9359 |
| Topological Polar Surface Area | 71.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 461.0092 |
| Heavy Atoms | 29 |
| Complexity | 1040.5378 |
Chemical Identifiers
| CAS Number | 339096-85-4 |
|---|---|
| SMILES | CN1C(=CN=C1SC2=C(C=C(C=N2)C(F)(F)F)Cl)NC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
8H-010 (CAS 339096-85-4), with molecular formula C17H12Cl2F3N5OS and molecular weight 461.01 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-3-methylimidazol-4-yl]urea.
Chemical Property Profile of 8H-010
Property Insights of 8H-010
The XLogP value of 5.9359 indicates that 8H-010 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 8H-010. Following Lipinski's Rule of Five, 8H-010 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 8H-010?
The CAS number of 8H-010 is 339096-85-4.
What is the molecular formula of 8H-010?
The molecular formula of 8H-010 is C17H12Cl2F3N5OS.
What is the molecular weight of 8H-010?
The molecular weight of 8H-010 is 461.01 g/mol.
Where can I buy 8H-010?
You can request a quote for 8H-010 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8H-010?
Yes, KEHONG BIO provides custom synthesis services for 8H-010 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.