ChemDiv1_025729
TL;DR: ChemDiv1_025729 (CAS 312530-36-2) is a chemical compound with molecular formula C24H17ClO4 and molecular weight 404.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-2,3-dimethoxy-5H-indeno[1,2-c]isochromen-11-one
Also Known As: ChemDiv1_025729, 5-(4-chlorophenyl)-2,3-dimethoxyindeno[1,2-c]isochromen-11(5H)-one, 5-(4-chlorophenyl)-2,3-dimethoxy-5H-indeno[1,2-c]isochromen-11-one, A2013/0084540, 5-(4-chlorophenyl)-2,3-dimethoxy-5H,11H-indeno[1,2-c]isochromen-11-one
| Molecular Formula | C24H17ClO4 |
|---|---|
| Molecular Weight | 404.08 g/mol |
| LogP | 5.5414 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.08154 |
| Heavy Atoms | 29 |
| Complexity | 1177.9851 |
Chemical Identifiers
| CAS Number | 312530-36-2 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C(OC3=C2C(=O)C4=CC=CC=C43)C5=CC=C(C=C5)Cl)OC |
Product Overview
ChemDiv1_025729 (CAS 312530-36-2), with molecular formula C24H17ClO4 and molecular weight 404.08 g/mol. IUPAC: 5-(4-chlorophenyl)-2,3-dimethoxy-5H-indeno[1,2-c]isochromen-11-one.
Chemical Property Profile of ChemDiv1_025729
Property Insights of ChemDiv1_025729
The XLogP value of 5.5414 indicates that ChemDiv1_025729 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, ChemDiv1_025729 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_025729 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_025729?
The CAS number of ChemDiv1_025729 is 312530-36-2.
What is the molecular formula of ChemDiv1_025729?
The molecular formula of ChemDiv1_025729 is C24H17ClO4.
What is the molecular weight of ChemDiv1_025729?
The molecular weight of ChemDiv1_025729 is 404.08 g/mol.
Where can I buy ChemDiv1_025729?
You can request a quote for ChemDiv1_025729 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_025729?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_025729 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.