![1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea structure](/static/products/3383/338396-77-3.webp)
1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea
TL;DR: 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea (CAS 338396-77-3) is a chemical compound with molecular formula C11H12ClF3N4O2 and molecular weight 324.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methoxy]-3-(dimethylaminomethylidene)urea
Also Known As: 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea, N-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methoxy}-N-[(dimethylamino)methylene]urea, N'-({[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy}carbamoyl)-N,N-dimethylmethanimidamide, Na(2)-[[[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]methoxy]amino]carbonyl]-N,N-dimethylmethanimidamide
| Molecular Formula | C11H12ClF3N4O2 |
|---|---|
| Molecular Weight | 324.06 g/mol |
| LogP | 2.4849 |
| Topological Polar Surface Area | 66.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.0601 |
| Heavy Atoms | 21 |
| Complexity | 534.6899 |
Chemical Identifiers
| CAS Number | 338396-77-3 |
|---|---|
| SMILES | CN(C)C=NC(=O)NOCC1=C(C=C(C=N1)C(F)(F)F)Cl |
Product Overview
1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea (CAS 338396-77-3), with molecular formula C11H12ClF3N4O2 and molecular weight 324.06 g/mol. IUPAC: 1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methoxy]-3-(dimethylaminomethylidene)urea.
Chemical Property Profile of 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea
Property Insights of 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea
The XLogP value of 2.4849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea. The TPSA of 66.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea. Following Lipinski's Rule of Five, 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea has 1 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 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea?
The CAS number of 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea is 338396-77-3.
What is the molecular formula of 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea?
The molecular formula of 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea is C11H12ClF3N4O2.
What is the molecular weight of 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea?
The molecular weight of 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea is 324.06 g/mol.
Where can I buy 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea?
You can request a quote for 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]methoxy]-3-(dimethylaminomethylidene)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.