BRN 2316303
TL;DR: BRN 2316303 (CAS 40870-70-0) is a chemical compound with molecular formula C24H20O8 and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-dimethyl-3,6-dioxo-2-(phenoxycarbonyloxymethyl)cyclohexa-1,4-dien-1-yl]methyl phenyl carbonate
Also Known As: Carbonic acid, (4,5-dimethyl-3,6-dioxo-1,4-cyclohexadien-1,2-diyl)bis(methylene)diphenyl ester, 2,3-Dimethyl-5-(hydroxymethyl)-p-benzoquinone acetate (ester), [4,5-dimethyl-3,6-dioxo-2-(phenoxycarbonyloxymethyl)cyclohexa-1,4-dien-1-yl]methyl phenyl carbonate, (4,5-Dimethyl-3,6-dioxocyclohexa-1,4-diene-1,2-diyl)bis(methylene) diphenyl biscarbonate, (4,5-dimethyl-3,6-dioxo-2-{[(phenoxycarbonyl)oxy]methyl}cyclohexa-1,4-dien-1-yl)methyl phenyl carbonate
| Molecular Formula | C24H20O8 |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 436.1158 |
| Heavy Atoms | 32 |
| Complexity | 744.0 |
Chemical Identifiers
| CAS Number | 40870-70-0 |
|---|---|
| SMILES | CC1=C(C(=O)C(=C(C1=O)COC(=O)OC2=CC=CC=C2)COC(=O)OC3=CC=CC=C3)C |
| InChIKey | VLZXLTJNAGOOHO-UHFFFAOYSA-N |
Product Overview
BRN 2316303 (CAS 40870-70-0), with molecular formula C24H20O8 and molecular weight 436.12 g/mol. IUPAC: [4,5-dimethyl-3,6-dioxo-2-(phenoxycarbonyloxymethyl)cyclohexa-1,4-dien-1-yl]methyl phenyl carbonate.
Chemical Property Profile of BRN 2316303
Property Insights of BRN 2316303
The XLogP value of 4.1 indicates that BRN 2316303 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 2316303. Following Lipinski's Rule of Five, BRN 2316303 has 0 hydrogen bond donor(s) and 8 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 BRN 2316303?
The CAS number of BRN 2316303 is 40870-70-0.
What is the molecular formula of BRN 2316303?
The molecular formula of BRN 2316303 is C24H20O8.
What is the molecular weight of BRN 2316303?
The molecular weight of BRN 2316303 is 436.12 g/mol.
Where can I buy BRN 2316303?
You can request a quote for BRN 2316303 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 2316303?
Yes, KEHONG BIO provides custom synthesis services for BRN 2316303 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.