BAS 00386142
TL;DR: BAS 00386142 (CAS 302802-34-2) is a chemical compound with molecular formula C25H32O6 and molecular weight 428.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4,4-dimethyl-2,6-dioxocyclohexyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethylcyclohexane-1,3-dione
Also Known As: BAS 00386142, 2,2'-((3-(hydroxymethyl)-4-methoxyphenyl)methylene)bis(5,5-dimethylcyclohexane-1,3-dione), 2,2'-{[3-(hydroxymethyl)-4-methoxyphenyl]methanediyl}bis(5,5-dimethylcyclohexane-1,3-dione), 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethylcyclohexane-1,3-dione, 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethylcyclohexane-1,3-dione
| Molecular Formula | C25H32O6 |
|---|---|
| Molecular Weight | 428.22 g/mol |
| LogP | 3.4199 |
| Topological Polar Surface Area | 97.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.21988 |
| Heavy Atoms | 31 |
| Complexity | 837.93994 |
Chemical Identifiers
| CAS Number | 302802-34-2 |
|---|---|
| SMILES | CC1(CC(=O)C(C(=O)C1)C(C2C(=O)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OC)CO)C |
Product Overview
BAS 00386142 (CAS 302802-34-2), with molecular formula C25H32O6 and molecular weight 428.22 g/mol. IUPAC: 2-[(4,4-dimethyl-2,6-dioxocyclohexyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethylcyclohexane-1,3-dione.
Chemical Property Profile of BAS 00386142
Property Insights of BAS 00386142
The XLogP value of 3.4199 indicates that BAS 00386142 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00386142. Following Lipinski's Rule of Five, BAS 00386142 has 1 hydrogen bond donor(s) and 6 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 BAS 00386142?
The CAS number of BAS 00386142 is 302802-34-2.
What is the molecular formula of BAS 00386142?
The molecular formula of BAS 00386142 is C25H32O6.
What is the molecular weight of BAS 00386142?
The molecular weight of BAS 00386142 is 428.22 g/mol.
Where can I buy BAS 00386142?
You can request a quote for BAS 00386142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00386142?
Yes, KEHONG BIO provides custom synthesis services for BAS 00386142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.