SN 6113
TL;DR: SN 6113 (CAS 5441-75-8) is a chemical compound with molecular formula C34H30N6O4+2 and molecular weight 586.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N,3-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,3-dicarboxamide
Also Known As: R-Tetrahydropapaverine, SN 6113, 1-N,3-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,3-dicarboxamide, 3,3'-[benzene-1,3-diylbis(carbonyliminobenzene-4,1-diylcarbonylimino)]bis(1-methylpyridinium), (r)-1,2,3,4-tetrahydro-6,7-dimethoxy-1-veratrylisoquinoline;R-(+)-Tetrahydropapaverin
| Molecular Formula | C34H30N6O4+2 |
|---|---|
| Molecular Weight | 586.23 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 586.23285 |
| Heavy Atoms | 44 |
| Complexity | 916.0 |
Chemical Identifiers
| CAS Number | 5441-75-8 |
|---|---|
| SMILES | C[N+]1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(=O)NC4=CC=C(C=C4)C(=O)NC5=C[N+](=CC=C5)C |
| InChIKey | GYQKEYWJZGNSBJ-UHFFFAOYSA-P |
Product Overview
SN 6113 (CAS 5441-75-8), with molecular formula C34H30N6O4+2 and molecular weight 586.23 g/mol. IUPAC: 1-N,3-N-bis[4-[(1-methylpyridin-1-ium-3-yl)carbamoyl]phenyl]benzene-1,3-dicarboxamide.
Chemical Property Profile of SN 6113
Property Insights of SN 6113
The XLogP value of 3.4 indicates that SN 6113 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SN 6113. Following Lipinski's Rule of Five, SN 6113 has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SN 6113?
The CAS number of SN 6113 is 5441-75-8.
What is the molecular formula of SN 6113?
The molecular formula of SN 6113 is C34H30N6O4+2.
What is the molecular weight of SN 6113?
The molecular weight of SN 6113 is 586.23 g/mol.
Where can I buy SN 6113?
You can request a quote for SN 6113 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SN 6113?
Yes, KEHONG BIO provides custom synthesis services for SN 6113 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.