RefChem:319394
TL;DR: RefChem:319394 (CAS 18671-85-7) is a chemical compound with molecular formula C38H54Br2N4O6P2 and molecular weight 882.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diphenoxyphosphorylamino)ethyl-[6-[2-(diphenoxyphosphorylamino)ethyl-dimethylazaniumyl]hexyl]-dimethylazanium dibromide
Also Known As: 9014 HC, Hexamethylenebis(dimethyl(2-(diphenylphosphonoamino)ethyl)ammonium bromide), Ammonium, hexamethylenebis(dimethyl(2-(phosphonoamino)ethyl)-, dibromide, tetraphenyl ester, 2-(diphenoxyphosphorylamino)ethyl-[6-[2-(diphenoxyphosphorylamino)ethyl-dimethylazaniumyl]hexyl]-dimethylazanium dibromide, N~1~,N~6~-Bis{2-[(diphenoxyphosphoryl)amino]ethyl}-N~1~,N~1~,N~6~,N~6~-tetramethylhexane-1,6-bis(aminium) dibromide
| Molecular Formula | C38H54Br2N4O6P2 |
|---|---|
| Molecular Weight | 882.19 g/mol |
| LogP | 2.42 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 23 |
| Exact Mass | 884.18646 |
| Heavy Atoms | 52 |
| Complexity | 897.0 |
Chemical Identifiers
| CAS Number | 18671-85-7 |
|---|---|
| SMILES | C[N+](C)(CCCCCC[N+](C)(C)CCNP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)CCNP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4.[Br-].[Br-] |
| InChIKey | CQNWYIYAFLYUAV-UHFFFAOYSA-L |
Product Overview
RefChem:319394 (CAS 18671-85-7), with molecular formula C38H54Br2N4O6P2 and molecular weight 882.19 g/mol. IUPAC: 2-(diphenoxyphosphorylamino)ethyl-[6-[2-(diphenoxyphosphorylamino)ethyl-dimethylazaniumyl]hexyl]-dimethylazanium dibromide.
Chemical Property Profile of RefChem:319394
Property Insights of RefChem:319394
The XLogP value of 2.42 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:319394. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:319394. Following Lipinski's Rule of Five, RefChem:319394 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:319394?
The CAS number of RefChem:319394 is 18671-85-7.
What is the molecular formula of RefChem:319394?
The molecular formula of RefChem:319394 is C38H54Br2N4O6P2.
What is the molecular weight of RefChem:319394?
The molecular weight of RefChem:319394 is 882.19 g/mol.
Where can I buy RefChem:319394?
You can request a quote for RefChem:319394 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319394?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319394 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.