![3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea structure](/static/products/5396/53961-71-0.webp)
3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea
TL;DR: 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea (CAS 53961-71-0) is a chemical compound with molecular formula C18H22N4O4S and molecular weight 390.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[4-(dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea
Also Known As: N',N''-[Sulfonyldi(4,1-phenylene)]bis(N,N-dimethylurea), 3-[4-[4-(dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-d, 3-[4-[4-(dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea
| Molecular Formula | C18H22N4O4S |
|---|---|
| Molecular Weight | 390.14 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.13617 |
| Heavy Atoms | 27 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 53961-71-0 |
|---|---|
| SMILES | CN(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)N(C)C |
| InChIKey | FEOGHVYGISUEFT-UHFFFAOYSA-N |
Product Overview
3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea (CAS 53961-71-0), with molecular formula C18H22N4O4S and molecular weight 390.14 g/mol. IUPAC: 3-[4-[4-(dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea.
Chemical Property Profile of 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea
Property Insights of 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea. Following Lipinski's Rule of Five, 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea 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 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea?
The CAS number of 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea is 53961-71-0.
What is the molecular formula of 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea?
The molecular formula of 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea is C18H22N4O4S.
What is the molecular weight of 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea?
The molecular weight of 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea is 390.14 g/mol.
Where can I buy 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea?
You can request a quote for 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-[4-(Dimethylcarbamoylamino)phenyl]sulfonylphenyl]-1,1-dimethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.