2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate
TL;DR: 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate (CAS 72745-17-6) is a chemical compound with molecular formula C22H33NO6 and molecular weight 407.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzylamino)-3-cyclooctyloxypropan-2-ol;(E)-but-2-enedioic acid
Also Known As: 1-Benzylamino-3-cyclooctyloxy-2-propanol maleate, 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate, 1-Cyclooctyloxy-3-benzylamino-2-propanol hydrogenmaleat, 1-Cyclooctyloxy-3-benzylamino-2-propanol hydrogenmaleat [German], 1-(benzylamino)-3-cyclooctyloxypropan-2-ol; (E)-but-2-enedioic acid
| Molecular Formula | C22H33NO6 |
|---|---|
| Molecular Weight | 407.23 g/mol |
| LogP | 2.9784 |
| Topological Polar Surface Area | 116.09 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 407.23077 |
| Heavy Atoms | 29 |
| Complexity | 580.5799 |
Chemical Identifiers
| CAS Number | 72745-17-6 |
|---|---|
| SMILES | C1CCCC(CCC1)OCC(CNCC2=CC=CC=C2)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate (CAS 72745-17-6), with molecular formula C22H33NO6 and molecular weight 407.23 g/mol. IUPAC: 1-(benzylamino)-3-cyclooctyloxypropan-2-ol;(E)-but-2-enedioic acid.
Chemical Property Profile of 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate
Property Insights of 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate
The XLogP value of 2.9784 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate. The TPSA of 116.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate. Following Lipinski's Rule of Five, 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate has 4 hydrogen bond donor(s) and 5 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 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate?
The CAS number of 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate is 72745-17-6.
What is the molecular formula of 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate?
The molecular formula of 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate is C22H33NO6.
What is the molecular weight of 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate?
The molecular weight of 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate is 407.23 g/mol.
Where can I buy 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate?
You can request a quote for 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanol, 1-benzylamino-3-cyclooctyloxy-, maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.