![5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione structure](/static/products/3391/339101-14-3.webp)
5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione
TL;DR: 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione (CAS 339101-14-3) is a chemical compound with molecular formula C20H15Cl2F4N5O4 and molecular weight 535.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-1,3-diazinane-2,4,6-trione
Also Known As: 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione, 1-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-2,4,6-trioxohexahydro-5-pyrimidinecarbaldehyde O-(2-chloro-6-fluorobenzyl)oxime
| Molecular Formula | C20H15Cl2F4N5O4 |
|---|---|
| Molecular Weight | 535.04 g/mol |
| LogP | 3.8554 |
| Topological Polar Surface Area | 112.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.0437 |
| Heavy Atoms | 35 |
| Complexity | 1158.4395 |
Chemical Identifiers
| CAS Number | 339101-14-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CON=CC2C(=O)NC(=O)N(C2=O)CCNC3=C(C=C(C=N3)C(F)(F)F)Cl)F |
Product Overview
5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione (CAS 339101-14-3), with molecular formula C20H15Cl2F4N5O4 and molecular weight 535.04 g/mol. IUPAC: 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione
Property Insights of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione
The XLogP value of 3.8554 indicates that 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione is 339101-14-3.
What is the molecular formula of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione is C20H15Cl2F4N5O4.
What is the molecular weight of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione is 535.04 g/mol.
Where can I buy 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2-chloro-6-fluorophenyl)methoxyiminomethyl]-1-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.