RefChem:318983
TL;DR: RefChem:318983 (CAS 66967-66-6) is a chemical compound with molecular formula C38H74Br2N2O4 and molecular weight 780.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]ethoxy]-4-oxobutanoyl]oxyethyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide
Also Known As: Ammonium, (ethylenebis(carbonyloxyethylene))bis(1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl)bis(dimethyl-, dibromide, 2-[4-[2-[Dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]ethoxy]-4-oxobutanoyl]oxyethyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumdibromide, AMMONIUM, (ETHYLENEBIS(CARBONYLOXYETHYLENE))BIS(1-METHYL-3-(2,2,6-TRIMETHYLCYCLO, 2-[4-[2-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]ethoxy]-4-oxobutanoyl]oxyethyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide, Cyclohexanepropanaminium, N,N'-[(1,4-dioxo-1,4-butanediyl)bis(oxy-2,1-ethanediyl)]bis[N,N,.alpha.,2,2,6-hexamethyl-, dibromide
| Molecular Formula | C38H74Br2N2O4 |
|---|---|
| Molecular Weight | 780.40 g/mol |
| LogP | 2.28 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 19 |
| Exact Mass | 782.3995 |
| Heavy Atoms | 46 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 66967-66-6 |
|---|---|
| SMILES | CC1CCCC(C1CCC(C)[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C(C)CCC2C(CCCC2(C)C)C)(C)C.[Br-].[Br-] |
| InChIKey | RKMIHIRTJISVFH-UHFFFAOYSA-L |
Product Overview
RefChem:318983 (CAS 66967-66-6), with molecular formula C38H74Br2N2O4 and molecular weight 780.40 g/mol. IUPAC: 2-[4-[2-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]ethoxy]-4-oxobutanoyl]oxyethyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide.
Chemical Property Profile of RefChem:318983
Property Insights of RefChem:318983
The XLogP value of 2.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:318983. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:318983 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318983 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:318983?
The CAS number of RefChem:318983 is 66967-66-6.
What is the molecular formula of RefChem:318983?
The molecular formula of RefChem:318983 is C38H74Br2N2O4.
What is the molecular weight of RefChem:318983?
The molecular weight of RefChem:318983 is 780.40 g/mol.
Where can I buy RefChem:318983?
You can request a quote for RefChem:318983 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318983?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318983 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.