1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate
TL;DR: 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate (CAS 64011-59-2) is a chemical compound with molecular formula C22H42N2O4 and molecular weight 398.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;1-N,4-N-dicyclohexylcyclohexane-1,4-diamine
Also Known As: N,N'-Dicyclohexyl-1,4-cyclohexanediamine diacetate, 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate, N,N'-(1,4-Cyclohexylene)dicyclohexaneamine diacetate, n,n'-dicyclohexylcyclohexane-1,4-diamine acetate(1:2), Cyclohexaneamine, N,N'-(1,4-cyclohexylene)di-, diacetate
| Molecular Formula | C22H42N2O4 |
|---|---|
| Molecular Weight | 398.31 g/mol |
| LogP | 4.32 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.31445 |
| Heavy Atoms | 28 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 64011-59-2 |
|---|---|
| SMILES | CC(=O)O.CC(=O)O.C1CCC(CC1)NC2CCC(CC2)NC3CCCCC3 |
| InChIKey | NUEBHBJXPCGNAF-UHFFFAOYSA-N |
Product Overview
1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate (CAS 64011-59-2), with molecular formula C22H42N2O4 and molecular weight 398.31 g/mol. IUPAC: acetic acid;1-N,4-N-dicyclohexylcyclohexane-1,4-diamine.
Chemical Property Profile of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate
Property Insights of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate
The XLogP value of 4.32 indicates that 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate. Following Lipinski's Rule of Five, 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate?
The CAS number of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate is 64011-59-2.
What is the molecular formula of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate?
The molecular formula of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate is C22H42N2O4.
What is the molecular weight of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate?
The molecular weight of 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate is 398.31 g/mol.
Where can I buy 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate?
You can request a quote for 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Cyclohexanediamine, N,N'-dicyclohexyl-, diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.