3-(4-Benzoylphenyl)-1,1-dimethylurea
TL;DR: 3-(4-Benzoylphenyl)-1,1-dimethylurea (CAS 61706-06-7) is a chemical compound with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-benzoylphenyl)-1,1-dimethylurea
Also Known As: 3-(4-benzoylphenyl)-1,1-dimethylurea, N'-(4-Benzoylphenyl)-N,N-dimethylurea, 3-(4-benzoylphenyl)-1,1-dimethyl-urea, N,N-Dimethyl-N -(4-benzoylphenyl)urea, J1.606.925F
| Molecular Formula | C16H16N2O2 |
|---|---|
| Molecular Weight | 268.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.1212 |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 61706-06-7 |
|---|---|
| SMILES | CN(C)C(=O)NC1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
| InChIKey | NIMRZESMXKJDJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Benzoylphenyl)-1,1-dimethylurea (CAS 61706-06-7), with molecular formula C16H16N2O2 and molecular weight 268.12 g/mol. IUPAC: 3-(4-benzoylphenyl)-1,1-dimethylurea.
Chemical Property Profile of 3-(4-Benzoylphenyl)-1,1-dimethylurea
Property Insights of 3-(4-Benzoylphenyl)-1,1-dimethylurea
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Benzoylphenyl)-1,1-dimethylurea. With a topological polar surface area (TPSA) of 49.4 Ų, 3-(4-Benzoylphenyl)-1,1-dimethylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Benzoylphenyl)-1,1-dimethylurea 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 3-(4-Benzoylphenyl)-1,1-dimethylurea?
The CAS number of 3-(4-Benzoylphenyl)-1,1-dimethylurea is 61706-06-7.
What is the molecular formula of 3-(4-Benzoylphenyl)-1,1-dimethylurea?
The molecular formula of 3-(4-Benzoylphenyl)-1,1-dimethylurea is C16H16N2O2.
What is the molecular weight of 3-(4-Benzoylphenyl)-1,1-dimethylurea?
The molecular weight of 3-(4-Benzoylphenyl)-1,1-dimethylurea is 268.12 g/mol.
Where can I buy 3-(4-Benzoylphenyl)-1,1-dimethylurea?
You can request a quote for 3-(4-Benzoylphenyl)-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-Benzoylphenyl)-1,1-dimethylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Benzoylphenyl)-1,1-dimethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.