F0535-0990
TL;DR: F0535-0990 (CAS 449766-79-4) is a chemical compound with molecular formula C27H29NO6S and molecular weight 495.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[6,7-dimethoxy-2-(2-thiophen-2-ylacetyl)-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
Also Known As: F0535-0990, ethyl 4-((6,7-dimethoxy-2-(2-(thiophen-2-yl)acetyl)-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy)benzoate, Ethyl 4-[[6,7-dimethoxy-2-(2-thiophen-2-ylacetyl)-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate, ethyl 4-({6,7-dimethoxy-2-[2-(thiophen-2-yl)acetyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)benzoate, ethyl p-({6,7-dimethoxy-2-[2-(2-thienyl)acetyl]-1,2,3,4-tetrahydro-1-isoquinolyl}methoxy)benzoate
| Molecular Formula | C27H29NO6S |
|---|---|
| Molecular Weight | 495.17 g/mol |
| LogP | 4.6895 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 495.17157 |
| Heavy Atoms | 35 |
| Complexity | 1159.1696 |
Chemical Identifiers
| CAS Number | 449766-79-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)OCC2C3=CC(=C(C=C3CCN2C(=O)CC4=CC=CS4)OC)OC |
Product Overview
F0535-0990 (CAS 449766-79-4), with molecular formula C27H29NO6S and molecular weight 495.17 g/mol. IUPAC: ethyl 4-[[6,7-dimethoxy-2-(2-thiophen-2-ylacetyl)-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate.
Chemical Property Profile of F0535-0990
Property Insights of F0535-0990
The XLogP value of 4.6895 indicates that F0535-0990 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for F0535-0990. Following Lipinski's Rule of Five, F0535-0990 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 F0535-0990?
The CAS number of F0535-0990 is 449766-79-4.
What is the molecular formula of F0535-0990?
The molecular formula of F0535-0990 is C27H29NO6S.
What is the molecular weight of F0535-0990?
The molecular weight of F0535-0990 is 495.17 g/mol.
Where can I buy F0535-0990?
You can request a quote for F0535-0990 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0535-0990?
Yes, KEHONG BIO provides custom synthesis services for F0535-0990 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.