SN 7003
TL;DR: SN 7003 (CAS 81944-19-6) is a chemical compound with molecular formula C35H34N5O6S+ and molecular weight 652.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-[4-(aminomethyl)phenyl]-4-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid
Also Known As: SN 7003, Pyridinium, 3-((4-((4-(((4-(aminomethyl)phenyl)amino)carbonyl)benzoyl)amino)benzoyl)amino)-1-methyl-, salt with 4-methylbenzensulfonic acid (1:1), 1-N-[4-(aminomethyl)phenyl]-4-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide; 4-methylbenzenesulfonic acid
| Molecular Formula | C35H34N5O6S+ |
|---|---|
| Molecular Weight | 652.22 g/mol |
| LogP | 4.96842 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 652.22296 |
| Heavy Atoms | 47 |
| Complexity | 944.0 |
Chemical Identifiers
| CAS Number | 81944-19-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)CN |
| InChIKey | JMTVVEQASPYOEI-UHFFFAOYSA-O |
Product Overview
SN 7003 (CAS 81944-19-6), with molecular formula C35H34N5O6S+ and molecular weight 652.22 g/mol. IUPAC: 1-N-[4-(aminomethyl)phenyl]-4-N-[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,4-dicarboxamide;4-methylbenzenesulfonic acid.
Chemical Property Profile of SN 7003
Property Insights of SN 7003
The XLogP value of 4.96842 indicates that SN 7003 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.0 Ų indicates high polarity, suggesting SN 7003 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SN 7003 has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SN 7003?
The CAS number of SN 7003 is 81944-19-6.
What is the molecular formula of SN 7003?
The molecular formula of SN 7003 is C35H34N5O6S+.
What is the molecular weight of SN 7003?
The molecular weight of SN 7003 is 652.22 g/mol.
Where can I buy SN 7003?
You can request a quote for SN 7003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SN 7003?
Yes, KEHONG BIO provides custom synthesis services for SN 7003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.