F0535-0970
TL;DR: F0535-0970 (CAS 449766-72-7) is a chemical compound with molecular formula C28H29NO7 and molecular weight 491.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[(E)-3-(furan-2-yl)prop-2-enoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
Also Known As: F0535-0970, (E)-ethyl 4-((2-(3-(furan-2-yl)acryloyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy)benzoate, ETHYL 4-({2-[(2E)-3-(FURAN-2-YL)PROP-2-ENOYL]-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLIN-1-YL}METHOXY)BENZOATE, ethyl 4-[[2-[(E)-3-(furan-2-yl)prop-2-enoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
| Molecular Formula | C28H29NO7 |
|---|---|
| Molecular Weight | 491.19 g/mol |
| LogP | 4.6917 |
| Topological Polar Surface Area | 87.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 491.1944 |
| Heavy Atoms | 36 |
| Complexity | 1215.4501 |
Chemical Identifiers
| CAS Number | 449766-72-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2C(=O)/C=C/C4=CC=CO4)OC)OC |
Product Overview
F0535-0970 (CAS 449766-72-7), with molecular formula C28H29NO7 and molecular weight 491.19 g/mol. IUPAC: ethyl 4-[[2-[(E)-3-(furan-2-yl)prop-2-enoyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate.
Chemical Property Profile of F0535-0970
Property Insights of F0535-0970
The XLogP value of 4.6917 indicates that F0535-0970 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F0535-0970. Following Lipinski's Rule of Five, F0535-0970 has 0 hydrogen bond donor(s) and 7 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 F0535-0970?
The CAS number of F0535-0970 is 449766-72-7.
What is the molecular formula of F0535-0970?
The molecular formula of F0535-0970 is C28H29NO7.
What is the molecular weight of F0535-0970?
The molecular weight of F0535-0970 is 491.19 g/mol.
Where can I buy F0535-0970?
You can request a quote for F0535-0970 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0535-0970?
Yes, KEHONG BIO provides custom synthesis services for F0535-0970 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.