Bis(methidium)spermine
TL;DR: Bis(methidium)spermine (CAS 70940-03-3) is a chemical compound with molecular formula C52H58N10O2+2 and molecular weight 854.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,9-diamino-5-methylphenanthridin-5-ium-6-yl)-N-[3-[4-[3-[[4-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)benzoyl]amino]propylamino]butylamino]propyl]benzamide
Also Known As: Bis(methidium)spermine, Octadecanoic acid, 12-hydroxy-, homopolymer, calcium salt, 3,8-diamino-6-(4-{[3-({4-[(3-{[4-(3,9-diamino-5-methylphenanthridinium-6-yl)benzoyl]amino}propyl)amino]butyl}amino)propyl]carbamoyl}phenyl)-5-methylphenanthridinium, 6,6'-(1,4-Butanediylbis(imino-3,1-propanediyliminocarbonyl-4,1-phenylene))bis(3,8-diamino-5-methylphenanthridinium), (6Z)-3-Amino-6-[(4Z)-4-{16-[4-(3-amino-9-iminio-5-methyl-5,9-dihydrophenanthridin-6-yl)phenyl]-1-hydroxy-16-oxo-2,6,11,15-tetraazahexadecan-1-ylidene}cyclohexa-2,5-dien-1-ylidene]-8-imino-5-methyl-6,8-dihydrophenanthridin-5-ium
| Molecular Formula | C52H58N10O2+2 |
|---|---|
| Molecular Weight | 854.47 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 194.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 854.4744 |
| Heavy Atoms | 64 |
| Complexity | 1450.0 |
Chemical Identifiers
| CAS Number | 70940-03-3 |
|---|---|
| SMILES | C[N+]1=C2C=C(C=CC2=C3C=CC(=CC3=C1C4=CC=C(C=C4)C(=O)NCCCNCCCCNCCCNC(=O)C5=CC=C(C=C5)C6=C7C=CC(=CC7=C8C=CC(=CC8=[N+]6C)N)N)N)N |
| InChIKey | DZJVNNCHNJBEKU-UHFFFAOYSA-P |
Product Overview
Bis(methidium)spermine (CAS 70940-03-3), with molecular formula C52H58N10O2+2 and molecular weight 854.47 g/mol. IUPAC: 4-(3,9-diamino-5-methylphenanthridin-5-ium-6-yl)-N-[3-[4-[3-[[4-(3,8-diamino-5-methylphenanthridin-5-ium-6-yl)benzoyl]amino]propylamino]butylamino]propyl]benzamide.
Chemical Property Profile of Bis(methidium)spermine
Property Insights of Bis(methidium)spermine
The XLogP value of 6.6 indicates that Bis(methidium)spermine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 194.0 Ų indicates high polarity, suggesting Bis(methidium)spermine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis(methidium)spermine has 8 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 Bis(methidium)spermine?
The CAS number of Bis(methidium)spermine is 70940-03-3.
What is the molecular formula of Bis(methidium)spermine?
The molecular formula of Bis(methidium)spermine is C52H58N10O2+2.
What is the molecular weight of Bis(methidium)spermine?
The molecular weight of Bis(methidium)spermine is 854.47 g/mol.
Where can I buy Bis(methidium)spermine?
You can request a quote for Bis(methidium)spermine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(methidium)spermine?
Yes, KEHONG BIO provides custom synthesis services for Bis(methidium)spermine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.