![[(4'-NO2)Phe5]bradykinin structure](/static/products/5716/57164-71-3.webp)
[(4'-NO2)Phe5]bradykinin
TL;DR: [(4'-NO2)Phe5]bradykinin (CAS 57164-71-3) is a chemical compound with molecular formula C23H22F3N3O6S2 and molecular weight 557.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanesulfonic acid;N-[3-methoxy-4-[[3-(trifluoromethyl)acridin-9-yl]amino]phenyl]methanesulfonamide
Also Known As: [(4'-NO2)Phe5]bradykinin|Methanesulfonamide, N-(3-methoxy-4-((3-(trifluoromethyl)-9-acridinyl)amino)phenyl)-, monomethanesulfonate|methanesulfonic acid; N-[3-methoxy-4-[[3-(trifluoromethyl)acridin-9-yl]amino]phenyl]methanesulfonamide|methanesulfonic acid,N-[3-methoxy-4-[[3-(trifluoromethyl)acridin-9-yl]amino]phenyl]methanesulfonamide|Methanesulfonic acid--N-(3-methoxy-4-{[3-(trifluoromethyl)acridin-9-yl]amino}phenyl)methanesulfonamide (1/1)
| Molecular Formula | C23H22F3N3O6S2 |
|---|---|
| Molecular Weight | 557.09 g/mol |
| LogP | 5.0345 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 557.0902 |
| Heavy Atoms | 37 |
| Complexity | 837.0 |
Chemical Identifiers
| CAS Number | 57164-71-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC(=CC3=NC4=CC=CC=C42)C(F)(F)F.CS(=O)(=O)O |
| InChIKey | XNBNQLVSJZQVKF-UHFFFAOYSA-N |
Product Overview
[(4'-NO2)Phe5]bradykinin (CAS 57164-71-3), with molecular formula C23H22F3N3O6S2 and molecular weight 557.09 g/mol. IUPAC: methanesulfonic acid;N-[3-methoxy-4-[[3-(trifluoromethyl)acridin-9-yl]amino]phenyl]methanesulfonamide.
Chemical Property Profile of [(4'-NO2)Phe5]bradykinin
Property Insights of [(4'-NO2)Phe5]bradykinin
The XLogP value of 5.0345 indicates that [(4'-NO2)Phe5]bradykinin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting [(4'-NO2)Phe5]bradykinin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [(4'-NO2)Phe5]bradykinin has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [(4'-NO2)Phe5]bradykinin?
The CAS number of [(4'-NO2)Phe5]bradykinin is 57164-71-3.
What is the molecular formula of [(4'-NO2)Phe5]bradykinin?
The molecular formula of [(4'-NO2)Phe5]bradykinin is C23H22F3N3O6S2.
What is the molecular weight of [(4'-NO2)Phe5]bradykinin?
The molecular weight of [(4'-NO2)Phe5]bradykinin is 557.09 g/mol.
Where can I buy [(4'-NO2)Phe5]bradykinin?
You can request a quote for [(4'-NO2)Phe5]bradykinin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(4'-NO2)Phe5]bradykinin?
Yes, KEHONG BIO provides custom synthesis services for [(4'-NO2)Phe5]bradykinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.