SR 2166
TL;DR: SR 2166 (CAS 67987-16-0) is a chemical compound with molecular formula C47H46Cl2N8O2 and molecular weight 824.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)-N-[5-[[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)benzoyl]amino]pentyl]benzamide dichloride
Also Known As: SR 2166, Phenanthridinium, 6,6'-(1,5-pentanediylbis(iminocarbonyl-3,1-phenylene))bis(3,8-diamino-5-methyl-, dichloride, 3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)-N-[5-[[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)benzoyl]amino]pentyl]benzamide dichloride
| Molecular Formula | C47H46Cl2N8O2 |
|---|---|
| Molecular Weight | 824.31 g/mol |
| LogP | 0.9493 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 824.3121 |
| Heavy Atoms | 59 |
| Complexity | 1250.0 |
Chemical Identifiers
| CAS Number | 67987-16-0 |
|---|---|
| SMILES | C[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC(=CC=C4)C(=O)NCCCCCNC(=O)C5=CC=CC(=C5)C6=C7C=C(C=CC7=C8C=CC(=CC8=[N+]6C)N)N)N)N.[Cl-].[Cl-] |
| InChIKey | OZCNARSTIBBOHL-UHFFFAOYSA-N |
Product Overview
SR 2166 (CAS 67987-16-0), with molecular formula C47H46Cl2N8O2 and molecular weight 824.31 g/mol. IUPAC: 3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)-N-[5-[[3-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)benzoyl]amino]pentyl]benzamide dichloride.
Chemical Property Profile of SR 2166
Property Insights of SR 2166
The XLogP value of 0.9493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SR 2166. The TPSA of 170.0 Ų indicates high polarity, suggesting SR 2166 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SR 2166 has 6 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 SR 2166?
The CAS number of SR 2166 is 67987-16-0.
What is the molecular formula of SR 2166?
The molecular formula of SR 2166 is C47H46Cl2N8O2.
What is the molecular weight of SR 2166?
The molecular weight of SR 2166 is 824.31 g/mol.
Where can I buy SR 2166?
You can request a quote for SR 2166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SR 2166?
Yes, KEHONG BIO provides custom synthesis services for SR 2166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.