ChemDiv3_004576
TL;DR: ChemDiv3_004576 (CAS 374546-69-7) is a chemical compound with molecular formula C23H19FO4 and molecular weight 378.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(3-fluoro-4-methoxyphenyl)-7-methyl-1,2,3,4-tetrahydro-[1]benzofuro[6,5-c]isochromen-5-one
Also Known As: ChemDiv3_004576, IDI1_022486, 10-(3-fluoro-4-methoxyphenyl)-7-methyl-1,2,3,4-tetrahydro-5H-benzo[c]furo[3,2-g]chromen-5-one, BRD-K03331204-001-01-3, 10-(3-fluoro-4-methoxyphenyl)-7-methyl-1,2,3,4-tetrahydro-[1]benzofuro[6,5-c]isochromen-5-one
| Molecular Formula | C23H19FO4 |
|---|---|
| Molecular Weight | 378.13 g/mol |
| LogP | 5.54112 |
| Topological Polar Surface Area | 52.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.12674 |
| Heavy Atoms | 28 |
| Complexity | 1295.9309 |
Chemical Identifiers
| CAS Number | 374546-69-7 |
|---|---|
| SMILES | CC1=C2C(=CC3=C1OC(=O)C4=C3CCCC4)C(=CO2)C5=CC(=C(C=C5)OC)F |
Product Overview
ChemDiv3_004576 (CAS 374546-69-7), with molecular formula C23H19FO4 and molecular weight 378.13 g/mol. IUPAC: 10-(3-fluoro-4-methoxyphenyl)-7-methyl-1,2,3,4-tetrahydro-[1]benzofuro[6,5-c]isochromen-5-one.
Chemical Property Profile of ChemDiv3_004576
Property Insights of ChemDiv3_004576
The XLogP value of 5.54112 indicates that ChemDiv3_004576 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.58 Ų, ChemDiv3_004576 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_004576 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 ChemDiv3_004576?
The CAS number of ChemDiv3_004576 is 374546-69-7.
What is the molecular formula of ChemDiv3_004576?
The molecular formula of ChemDiv3_004576 is C23H19FO4.
What is the molecular weight of ChemDiv3_004576?
The molecular weight of ChemDiv3_004576 is 378.13 g/mol.
Where can I buy ChemDiv3_004576?
You can request a quote for ChemDiv3_004576 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_004576?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_004576 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.