(8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron
TL;DR: (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron (CAS 50293-39-5) is a chemical compound with molecular formula C32H18FeN12 and molecular weight 626.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,18-diphenyl-2,4,7,16,18,21,29,30,31,32-decaza-5,19-diazanidaheptacyclo[20.6.1.13,6.18,15.117,20.09,14.023,28]dotriaconta-1,3(32),6,8(31),9,11,13,15,17(30),20,22(29),23,25,27-tetradecaene;iron(2+)
Also Known As: (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron, Iron, (8,20-dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloeicosinato(2-)-kappaN25,kappaN26,kappaN27,kappaN28)-, (SP-4-1)-, Iron, (8,20-dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloeicosinato(2-)-N25,N26,N27,N28)-, (SP-4-1)-, Iron, [8,20-dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz[f,p][1,2,4,9,11,12,14,19]octaazacycloeicosinato(2-)-.kappa.N25,.kappa.N26,.kappa.N27,.kappa.N28]-, (SP-4-1)-, [8,20-dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz[f,p][1,2,4,9,11,12,14,19]octaazacycloicosinato(2-)-N25,N26,N27,N28]iron
| Molecular Formula | C32H18FeN12 |
|---|---|
| Molecular Weight | 626.11 g/mol |
| LogP | 5.4533 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 626.1127 |
| Heavy Atoms | 45 |
| Complexity | 1330.0 |
Chemical Identifiers
| CAS Number | 50293-39-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C3=NC(=NC4=NC(=NC5=NC(=NC6=NC(=N3)C7=CC=CC=C76)[N-]N5C8=CC=CC=C8)C9=CC=CC=C94)[N-]2.[Fe+2] |
| InChIKey | LBBSBHXZSVMVEC-UHFFFAOYSA-N |
Product Overview
(8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron (CAS 50293-39-5), with molecular formula C32H18FeN12 and molecular weight 626.11 g/mol. IUPAC: 4,18-diphenyl-2,4,7,16,18,21,29,30,31,32-decaza-5,19-diazanidaheptacyclo[20.6.1.13,6.18,15.117,20.09,14.023,28]dotriaconta-1,3(32),6,8(31),9,11,13,15,17(30),20,22(29),23,25,27-tetradecaene;iron(2+).
Chemical Property Profile of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron
Property Insights of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron
The XLogP value of 5.4533 indicates that (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron. Following Lipinski's Rule of Five, (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron?
The CAS number of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron is 50293-39-5.
What is the molecular formula of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron?
The molecular formula of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron is C32H18FeN12.
What is the molecular weight of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron?
The molecular weight of (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron is 626.11 g/mol.
Where can I buy (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron?
You can request a quote for (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron?
Yes, KEHONG BIO provides custom synthesis services for (8,20-Dihydro-8,20-diphenyl-5,24:12,17-diimino-7,10:22,19-dinitrilodibenz(f,p)(1,2,4,9,11,12,14,19)octaazacycloicosinato(2-)-N25,N26,N27,N28)iron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.