1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride
TL;DR: 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride (CAS 51734-38-4) is a chemical compound with molecular formula C24H44Cl2N2O2 and molecular weight 462.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[bis(2-methylpropyl)amino]-3-(dipropylamino)propan-2-yl] benzoate;dihydrochloride
Also Known As: 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride, 2-Propanol, 1-(bis(2-methylpropyl)amino)-3-(dipropylamino)-, benzoate (ester), dihydrochloride, [1-[bis(2-methylpropyl)amino]-3-(dipropylamino)propan-2-yl] benzoate dihydrochloride, 1-[Bis(2-methylpropyl)amino]-3-(dipropylamino)propan-2-yl benzoate--hydrogen chloride (1/2), RefChem:265807
| Molecular Formula | C24H44Cl2N2O2 |
|---|---|
| Molecular Weight | 462.28 g/mol |
| LogP | 5.7916 |
| Topological Polar Surface Area | 32.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 462.27798 |
| Heavy Atoms | 30 |
| Complexity | 525.2673 |
Chemical Identifiers
| CAS Number | 51734-38-4 |
|---|---|
| SMILES | CCCN(CCC)CC(CN(CC(C)C)CC(C)C)OC(=O)C1=CC=CC=C1.Cl.Cl |
Product Overview
1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride (CAS 51734-38-4), with molecular formula C24H44Cl2N2O2 and molecular weight 462.28 g/mol. IUPAC: [1-[bis(2-methylpropyl)amino]-3-(dipropylamino)propan-2-yl] benzoate;dihydrochloride.
Chemical Property Profile of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride
Property Insights of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride
The XLogP value of 5.7916 indicates that 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.78 Ų, 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride?
The CAS number of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride is 51734-38-4.
What is the molecular formula of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride?
The molecular formula of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride is C24H44Cl2N2O2.
What is the molecular weight of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride?
The molecular weight of 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride is 462.28 g/mol.
Where can I buy 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride?
You can request a quote for 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(Diisobutylamino)-3-dipropylamino-2-propanol benzoate dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.