1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea
TL;DR: 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea (CAS 338404-01-6) is a chemical compound with molecular formula C11H13Cl2N3O2 and molecular weight 289.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dichlorophenyl)methoxy]-3-(dimethylaminomethylidene)urea
Also Known As: 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea, 1-[(3,4-dichlorophenyl)methoxy]-3-[(E)-(dimethylamino)methylidene]urea, 1-[(3,4-dichlorophenyl)methoxy]-3-(dimethylaminomethylene)urea, N-[(3,4-dichlorobenzyl)oxy]-N-[(dimethylamino)methylene]urea, 1-[(3,4-dichlorophenyl)methoxy]-3-(dimethylaminomethylidene)urea
| Molecular Formula | C11H13Cl2N3O2 |
|---|---|
| Molecular Weight | 289.04 g/mol |
| LogP | 2.7245 |
| Topological Polar Surface Area | 53.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.03848 |
| Heavy Atoms | 18 |
| Complexity | 449.91452 |
Chemical Identifiers
| CAS Number | 338404-01-6 |
|---|---|
| SMILES | CN(C)C=NC(=O)NOCC1=CC(=C(C=C1)Cl)Cl |
Product Overview
1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea (CAS 338404-01-6), with molecular formula C11H13Cl2N3O2 and molecular weight 289.04 g/mol. IUPAC: 1-[(3,4-dichlorophenyl)methoxy]-3-(dimethylaminomethylidene)urea.
Chemical Property Profile of 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea
Property Insights of 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea
The XLogP value of 2.7245 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea. With a topological polar surface area (TPSA) of 53.93 Ų, 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea has 1 hydrogen bond donor(s) and 2 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-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea?
The CAS number of 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea is 338404-01-6.
What is the molecular formula of 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea?
The molecular formula of 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea is C11H13Cl2N3O2.
What is the molecular weight of 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea?
The molecular weight of 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea is 289.04 g/mol.
Where can I buy 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea?
You can request a quote for 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3,4-dichlorophenyl)methoxy]-3-[(1E)-(dimethylamino)methylidene]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.