ChemDiv1_025670
TL;DR: ChemDiv1_025670 (CAS 304455-40-1) is a chemical compound with molecular formula C23H28O5 and molecular weight 384.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(3-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
Also Known As: ChemDiv1_025670, AB00075130-01, A1669/0071167, 2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(3-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione, 2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(3-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
| Molecular Formula | C23H28O5 |
|---|---|
| Molecular Weight | 384.19 g/mol |
| LogP | 4.2514 |
| Topological Polar Surface Area | 91.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.19366 |
| Heavy Atoms | 28 |
| Complexity | 854.7338 |
Chemical Identifiers
| CAS Number | 304455-40-1 |
|---|---|
| SMILES | CC1(CC(=O)C(C(=O)C1)C(C2=CC(=CC=C2)O)C3=C(CC(CC3=O)(C)C)O)C |
Product Overview
ChemDiv1_025670 (CAS 304455-40-1), with molecular formula C23H28O5 and molecular weight 384.19 g/mol. IUPAC: 2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(3-hydroxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione.
Chemical Property Profile of ChemDiv1_025670
Property Insights of ChemDiv1_025670
The XLogP value of 4.2514 indicates that ChemDiv1_025670 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.67 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_025670. Following Lipinski's Rule of Five, ChemDiv1_025670 has 2 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 ChemDiv1_025670?
The CAS number of ChemDiv1_025670 is 304455-40-1.
What is the molecular formula of ChemDiv1_025670?
The molecular formula of ChemDiv1_025670 is C23H28O5.
What is the molecular weight of ChemDiv1_025670?
The molecular weight of ChemDiv1_025670 is 384.19 g/mol.
Where can I buy ChemDiv1_025670?
You can request a quote for ChemDiv1_025670 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_025670?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_025670 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.