F0535-0875
TL;DR: F0535-0875 (CAS 486452-99-7) is a chemical compound with molecular formula C27H25ClN2O8 and molecular weight 540.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[2-(4-chloro-3-nitrobenzoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
Also Known As: F0535-0875, methyl 4-{[2-(4-chloro-3-nitrobenzoyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate, methyl 4-((2-(4-chloro-3-nitrobenzoyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy)benzoate, methyl 4-[[2-(4-chloro-3-nitrobenzoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
| Molecular Formula | C27H25ClN2O8 |
|---|---|
| Molecular Weight | 540.13 g/mol |
| LogP | 4.8706 |
| Topological Polar Surface Area | 117.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 540.12994 |
| Heavy Atoms | 38 |
| Complexity | 1376.2357 |
Chemical Identifiers
| CAS Number | 486452-99-7 |
|---|---|
| SMILES | COC1=C(C=C2C(N(CCC2=C1)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])COC4=CC=C(C=C4)C(=O)OC)OC |
Product Overview
F0535-0875 (CAS 486452-99-7), with molecular formula C27H25ClN2O8 and molecular weight 540.13 g/mol. IUPAC: methyl 4-[[2-(4-chloro-3-nitrobenzoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate.
Chemical Property Profile of F0535-0875
Property Insights of F0535-0875
The XLogP value of 4.8706 indicates that F0535-0875 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F0535-0875. Following Lipinski's Rule of Five, F0535-0875 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0535-0875?
The CAS number of F0535-0875 is 486452-99-7.
What is the molecular formula of F0535-0875?
The molecular formula of F0535-0875 is C27H25ClN2O8.
What is the molecular weight of F0535-0875?
The molecular weight of F0535-0875 is 540.13 g/mol.
Where can I buy F0535-0875?
You can request a quote for F0535-0875 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0535-0875?
Yes, KEHONG BIO provides custom synthesis services for F0535-0875 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.