[[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea
TL;DR: [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea (CAS 6630-49-5) is a chemical compound with molecular formula C11H14ClN3O3 and molecular weight 271.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[1-(4-chlorophenyl)-2,2-dimethoxyethylidene]amino]urea
Also Known As: NCIOpen2_002875, [[1-(4-chlorophenyl)-2,2-dimethoxyethylidene]amino]urea, [(Z)-[1-(4-chlorophenyl)-2,2-dimethoxyethylidene]amino]urea, 2-[1-(4-chlorophenyl)-2,2-dimethoxyethylidene]hydrazinecarboxamide
| Molecular Formula | C11H14ClN3O3 |
|---|---|
| Molecular Weight | 271.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 85.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.07236 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 6630-49-5 |
|---|---|
| SMILES | COC(C(=NNC(=O)N)C1=CC=C(C=C1)Cl)OC |
| InChIKey | FJZUUAPEZFZEPB-UHFFFAOYSA-N |
Product Overview
[[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea (CAS 6630-49-5), with molecular formula C11H14ClN3O3 and molecular weight 271.07 g/mol. IUPAC: [[1-(4-chlorophenyl)-2,2-dimethoxyethylidene]amino]urea.
Chemical Property Profile of [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea
Property Insights of [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea. The TPSA of 85.9 Ų falls within the moderate polarity range, balancing permeability and solubility for [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea. Following Lipinski's Rule of Five, [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea has 2 hydrogen bond donor(s) and 4 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-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea?
The CAS number of [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea is 6630-49-5.
What is the molecular formula of [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea?
The molecular formula of [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea is C11H14ClN3O3.
What is the molecular weight of [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea?
The molecular weight of [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea is 271.07 g/mol.
Where can I buy [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea?
You can request a quote for [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea?
Yes, KEHONG BIO provides custom synthesis services for [[1-(4-Chlorophenyl)-2,2-dimethoxyethylidene]amino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.