RefChem:318967
TL;DR: RefChem:318967 (CAS 66902-64-5) is a chemical compound with molecular formula C36H73Cl2N3O and molecular weight 633.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[acetyl-[dimethyl-[3-methyl-5-(2,2,6-trimethylcyclohexyl)pentyl]azaniumyl]amino]-dimethyl-[3-methyl-5-(2,2,6-trimethylcyclohexyl)pentyl]azanium dichloride
Also Known As: Ammonium, (acetylimino)diethylenebis(1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl)bis(dimethyl-, dichloride, dihydrate, [acetyl-[dimethyl-[3-methyl-5-(2,2,6-trimethylcyclohexyl)pentyl]azaniumyl]amino]-dimethyl-[3-methyl-5-(2,2,6-trimethylcyclohexyl)pentyl]azanium dichloride, AMMONIUM, (ACETYLIMINO)DIETHYLENEBIS(1-METHYL-3-(2,2,6-TRIMETHYLCYCLOHEXYL)PROPY, 2-acetyl-1,1,3,3-tetramethyl-1,3-bis[3-methyl-5-(2,2,6-trimethylcyclohexyl)pentyl]triazane-1,3-diium dichloride, Cyclohexanepropanaminium, N,N'-[(acetylimino)di-2,1-ethanediyl]bis[N,N,.alpha.,2,2,6-hexamethyl-, dichloride, dihydrate
| Molecular Formula | C36H73Cl2N3O |
|---|---|
| Molecular Weight | 633.51 g/mol |
| LogP | 3.36 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 633.51306 |
| Heavy Atoms | 42 |
| Complexity | 727.0 |
Chemical Identifiers
| CAS Number | 66902-64-5 |
|---|---|
| SMILES | CC1CCCC(C1CCC(C)CC[N+](C)(C)N(C(=O)C)[N+](C)(C)CCC(C)CCC2C(CCCC2(C)C)C)(C)C.[Cl-].[Cl-] |
| InChIKey | MBFNTQZSTAWIGD-UHFFFAOYSA-L |
Product Overview
RefChem:318967 (CAS 66902-64-5), with molecular formula C36H73Cl2N3O and molecular weight 633.51 g/mol. IUPAC: [acetyl-[dimethyl-[3-methyl-5-(2,2,6-trimethylcyclohexyl)pentyl]azaniumyl]amino]-dimethyl-[3-methyl-5-(2,2,6-trimethylcyclohexyl)pentyl]azanium dichloride.
Chemical Property Profile of RefChem:318967
Property Insights of RefChem:318967
The XLogP value of 3.36 indicates that RefChem:318967 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, RefChem:318967 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318967 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:318967?
The CAS number of RefChem:318967 is 66902-64-5.
What is the molecular formula of RefChem:318967?
The molecular formula of RefChem:318967 is C36H73Cl2N3O.
What is the molecular weight of RefChem:318967?
The molecular weight of RefChem:318967 is 633.51 g/mol.
Where can I buy RefChem:318967?
You can request a quote for RefChem:318967 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318967?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318967 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.