8L-906
TL;DR: 8L-906 (CAS 339101-09-6) is a chemical compound with molecular formula C19H14ClF3IN5O3 and molecular weight 578.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-6-hydroxy-5-[(4-iodophenyl)iminomethyl]pyrimidine-2,4-dione
Also Known As: 8L-906, 1-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-5-[(4-iodoanilino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione, (5E)-1-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}ethyl)-5-{[(4-iodophenyl)amino]methylidene}-1,3-diazinane-2,4,6-trione, 1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-6-hydroxy-5-[(4-iodophenyl)iminomethyl]pyrimidine-2,4-dione, (5E)-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-5-[(4-iodoanilino)methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C19H14ClF3IN5O3 |
|---|---|
| Molecular Weight | 578.98 g/mol |
| LogP | 3.7767 |
| Topological Polar Surface Area | 112.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 578.9782 |
| Heavy Atoms | 32 |
| Complexity | 1273.1707 |
Chemical Identifiers
| CAS Number | 339101-09-6 |
|---|---|
| SMILES | C1=CC(=CC=C1N=CC2=C(N(C(=O)NC2=O)CCNC3=C(C=C(C=N3)C(F)(F)F)Cl)O)I |
Product Overview
8L-906 (CAS 339101-09-6), with molecular formula C19H14ClF3IN5O3 and molecular weight 578.98 g/mol. IUPAC: 1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-6-hydroxy-5-[(4-iodophenyl)iminomethyl]pyrimidine-2,4-dione.
Chemical Property Profile of 8L-906
Property Insights of 8L-906
The XLogP value of 3.7767 indicates that 8L-906 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 8L-906. Following Lipinski's Rule of Five, 8L-906 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8L-906?
The CAS number of 8L-906 is 339101-09-6.
What is the molecular formula of 8L-906?
The molecular formula of 8L-906 is C19H14ClF3IN5O3.
What is the molecular weight of 8L-906?
The molecular weight of 8L-906 is 578.98 g/mol.
Where can I buy 8L-906?
You can request a quote for 8L-906 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8L-906?
Yes, KEHONG BIO provides custom synthesis services for 8L-906 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.