F0535-0894
TL;DR: F0535-0894 (CAS 449766-29-4) is a chemical compound with molecular formula C28H30N2O6 and molecular weight 490.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
Also Known As: F0535-0894, methyl 4-((6,7-dimethoxy-2-(m-tolylcarbamoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy)benzoate, methyl 4-({6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)benzoate, methyl 4-[[6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
| Molecular Formula | C28H30N2O6 |
|---|---|
| Molecular Weight | 490.21 g/mol |
| LogP | 5.00912 |
| Topological Polar Surface Area | 86.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 490.2104 |
| Heavy Atoms | 36 |
| Complexity | 1241.2874 |
Chemical Identifiers
| CAS Number | 449766-29-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)N2CCC3=CC(=C(C=C3C2COC4=CC=C(C=C4)C(=O)OC)OC)OC |
Product Overview
F0535-0894 (CAS 449766-29-4), with molecular formula C28H30N2O6 and molecular weight 490.21 g/mol. IUPAC: methyl 4-[[6,7-dimethoxy-2-[(3-methylphenyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate.
Chemical Property Profile of F0535-0894
Property Insights of F0535-0894
The XLogP value of 5.00912 indicates that F0535-0894 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.33 Ų falls within the moderate polarity range, balancing permeability and solubility for F0535-0894. Following Lipinski's Rule of Five, F0535-0894 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0535-0894?
The CAS number of F0535-0894 is 449766-29-4.
What is the molecular formula of F0535-0894?
The molecular formula of F0535-0894 is C28H30N2O6.
What is the molecular weight of F0535-0894?
The molecular weight of F0535-0894 is 490.21 g/mol.
Where can I buy F0535-0894?
You can request a quote for F0535-0894 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0535-0894?
Yes, KEHONG BIO provides custom synthesis services for F0535-0894 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.