![3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea structure](/static/products/1024/1024179-19-8.webp)
3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea
TL;DR: 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea (CAS 1024179-19-8) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(5-methyl-3-oxocyclohexen-1-yl)amino]phenyl]-3-phenylurea
Also Known As: 3-{4-[(5-methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea, 1-[4-[(5-methyl-3-oxocyclohexen-1-yl)amino]phenyl]-3-phenylurea, N-{4-[(5-methyl-3-oxo-1-cyclohexenyl)amino]phenyl}-N'-phenylurea, 1-[4-[(5-methyl-3-oxo-1-cyclohexenyl)amino]phenyl]-3-phenyl-urea, 1-[4-[(5-methyl-3-oxo-cyclohexen-1-yl)amino]phenyl]-3-phenyl-urea
| Molecular Formula | C20H21N3O2 |
|---|---|
| Molecular Weight | 335.16 g/mol |
| LogP | 4.6254 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.1634 |
| Heavy Atoms | 25 |
| Complexity | 782.3484 |
Chemical Identifiers
| CAS Number | 1024179-19-8 |
|---|---|
| SMILES | CC1CC(=CC(=O)C1)NC2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3 |
Product Overview
3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea (CAS 1024179-19-8), with molecular formula C20H21N3O2 and molecular weight 335.16 g/mol. IUPAC: 1-[4-[(5-methyl-3-oxocyclohexen-1-yl)amino]phenyl]-3-phenylurea.
Chemical Property Profile of 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea
Property Insights of 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea
The XLogP value of 4.6254 indicates that 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea. Following Lipinski's Rule of Five, 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea has 3 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 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea?
The CAS number of 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea is 1024179-19-8.
What is the molecular formula of 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea?
The molecular formula of 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea is C20H21N3O2.
What is the molecular weight of 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea?
The molecular weight of 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea is 335.16 g/mol.
Where can I buy 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea?
You can request a quote for 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-{4-[(5-Methyl-3-oxocyclohex-1-en-1-yl)amino]phenyl}-1-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.