C27H32Fno5
TL;DR: C27H32Fno5 (CAS 1024744-94-2) is a chemical compound with molecular formula C27H32FNO5 and molecular weight 469.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[1-(4-fluorophenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Also Known As: (2E)-1-[1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one, (E)-1-(1-(4-fluorophenyl)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one, (E)-1-[1-(4-fluorophenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
| Molecular Formula | C27H32FNO5 |
|---|---|
| Molecular Weight | 469.23 g/mol |
| LogP | 4.7596 |
| Topological Polar Surface Area | 68.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 469.22644 |
| Heavy Atoms | 34 |
| Complexity | 1028.4811 |
Chemical Identifiers
| CAS Number | 1024744-94-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCC3(CCCCC3C2C4=CC=C(C=C4)F)O |
Product Overview
C27H32Fno5 (CAS 1024744-94-2), with molecular formula C27H32FNO5 and molecular weight 469.23 g/mol. IUPAC: (E)-1-[1-(4-fluorophenyl)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one.
Chemical Property Profile of C27H32Fno5
Property Insights of C27H32Fno5
The XLogP value of 4.7596 indicates that C27H32Fno5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.23 Ų falls within the moderate polarity range, balancing permeability and solubility for C27H32Fno5. Following Lipinski's Rule of Five, C27H32Fno5 has 1 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 C27H32Fno5?
The CAS number of C27H32Fno5 is 1024744-94-2.
What is the molecular formula of C27H32Fno5?
The molecular formula of C27H32Fno5 is C27H32FNO5.
What is the molecular weight of C27H32Fno5?
The molecular weight of C27H32Fno5 is 469.23 g/mol.
Where can I buy C27H32Fno5?
You can request a quote for C27H32Fno5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H32Fno5?
Yes, KEHONG BIO provides custom synthesis services for C27H32Fno5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.