![2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one structure](/static/products/4712/471259-83-3.webp)
2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one
TL;DR: 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one (CAS 471259-83-3) is a chemical compound with molecular formula C21H29NO4 and molecular weight 359.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one
Also Known As: BAS 00866893, AB00096863-01, 2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one, 2,4-Diacetyl-3-(4-diethylamino-phenyl)-5-hydroxy-5-methyl-cyclohexanone, 2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexanone
| Molecular Formula | C21H29NO4 |
|---|---|
| Molecular Weight | 359.21 g/mol |
| LogP | 2.7506 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.20966 |
| Heavy Atoms | 26 |
| Complexity | 688.4675 |
Chemical Identifiers
| CAS Number | 471259-83-3 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)C)(C)O)C(=O)C |
Product Overview
2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one (CAS 471259-83-3), with molecular formula C21H29NO4 and molecular weight 359.21 g/mol. IUPAC: 2,4-diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one.
Chemical Property Profile of 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one
Property Insights of 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one
The XLogP value of 2.7506 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one. Following Lipinski's Rule of Five, 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one has 1 hydrogen bond donor(s) and 5 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 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one?
The CAS number of 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one is 471259-83-3.
What is the molecular formula of 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one?
The molecular formula of 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one is C21H29NO4.
What is the molecular weight of 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one?
The molecular weight of 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one is 359.21 g/mol.
Where can I buy 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one?
You can request a quote for 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diacetyl-3-[4-(diethylamino)phenyl]-5-hydroxy-5-methylcyclohexan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.