![3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one structure](/static/products/3308/330833-96-0.webp)
3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
TL;DR: 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one (CAS 330833-96-0) is a chemical compound with molecular formula C21H22N2O2 and molecular weight 334.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-amino-5-benzoylanilino)-5,5-dimethylcyclohex-2-en-1-one
Also Known As: 3-{[2-amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one, 3-(2-AMINO-5-BENZOYLANILINO)-5,5-DIMETHYL-2-CYCLOHEXEN-1-ONE, 3-(2-amino-5-benzoylanilino)-5,5-dimethylcyclohex-2-en-1-one, 3-((2-amino-5-benzoylphenyl)amino)-5,5-dimethylcyclohex-2-enone, 3-[(2-AMINO-5-BENZOYLPHENYL)AMINO]-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE
| Molecular Formula | C21H22N2O2 |
|---|---|
| Molecular Weight | 334.17 g/mol |
| LogP | 4.1847 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.16812 |
| Heavy Atoms | 25 |
| Complexity | 851.4547 |
Chemical Identifiers
| CAS Number | 330833-96-0 |
|---|---|
| SMILES | CC1(CC(=CC(=O)C1)NC2=C(C=CC(=C2)C(=O)C3=CC=CC=C3)N)C |
Product Overview
3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one (CAS 330833-96-0), with molecular formula C21H22N2O2 and molecular weight 334.17 g/mol. IUPAC: 3-(2-amino-5-benzoylanilino)-5,5-dimethylcyclohex-2-en-1-one.
Chemical Property Profile of 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
Property Insights of 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
The XLogP value of 4.1847 indicates that 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one. Following Lipinski's Rule of Five, 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one 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-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
The CAS number of 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is 330833-96-0.
What is the molecular formula of 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
The molecular formula of 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is C21H22N2O2.
What is the molecular weight of 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
The molecular weight of 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one is 334.17 g/mol.
Where can I buy 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
You can request a quote for 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-{[2-Amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.