F0535-0696
TL;DR: F0535-0696 (CAS 449766-16-9) is a chemical compound with molecular formula C25H24ClN3O6 and molecular weight 497.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
Also Known As: F0535-0696, N-(4-chlorophenyl)-6,7-dimethoxy-1-((4-nitrophenoxy)methyl)-3,4-dihydroisoquinoline-2(1H)-carboxamide, N-(4-chlorophenyl)-6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-2-carboxamide, N-(4-chlorophenyl)-6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
| Molecular Formula | C25H24ClN3O6 |
|---|---|
| Molecular Weight | 497.14 g/mol |
| LogP | 5.4757 |
| Topological Polar Surface Area | 103.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.13538 |
| Heavy Atoms | 35 |
| Complexity | 1217.1218 |
Chemical Identifiers
| CAS Number | 449766-16-9 |
|---|---|
| SMILES | COC1=C(C=C2C(N(CCC2=C1)C(=O)NC3=CC=C(C=C3)Cl)COC4=CC=C(C=C4)[N+](=O)[O-])OC |
Product Overview
F0535-0696 (CAS 449766-16-9), with molecular formula C25H24ClN3O6 and molecular weight 497.14 g/mol. IUPAC: N-(4-chlorophenyl)-6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide.
Chemical Property Profile of F0535-0696
Property Insights of F0535-0696
The XLogP value of 5.4757 indicates that F0535-0696 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.17 Ų falls within the moderate polarity range, balancing permeability and solubility for F0535-0696. Following Lipinski's Rule of Five, F0535-0696 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 F0535-0696?
The CAS number of F0535-0696 is 449766-16-9.
What is the molecular formula of F0535-0696?
The molecular formula of F0535-0696 is C25H24ClN3O6.
What is the molecular weight of F0535-0696?
The molecular weight of F0535-0696 is 497.14 g/mol.
Where can I buy F0535-0696?
You can request a quote for F0535-0696 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0535-0696?
Yes, KEHONG BIO provides custom synthesis services for F0535-0696 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.