Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride
TL;DR: Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride (CAS 102338-95-4) is a chemical compound with molecular formula C19H32Cl2N2O3 and molecular weight 406.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-piperidin-1-ylpropyl 4-(butylamino)-2-hydroxybenzoate;dihydrochloride
Also Known As: Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride, 4-Butylaminosalicylic acid 3-piperidinopropyl ester dihydrochloride, 3-piperidin-1-ylpropyl 4-(butylamino)-2-hydroxybenzoate,dihy, 3-piperidin-1-ylpropyl 4-(butylamino)-2-hydroxybenzoate dihydrochloride, 3-(Piperidin-1-yl)propyl 4-(butylamino)-2-hydroxybenzoate--hydrogen chloride (1/2)
| Molecular Formula | C19H32Cl2N2O3 |
|---|---|
| Molecular Weight | 406.18 g/mol |
| LogP | 4.4806 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 406.179 |
| Heavy Atoms | 26 |
| Complexity | 523.50574 |
Chemical Identifiers
| CAS Number | 102338-95-4 |
|---|---|
| SMILES | CCCCNC1=CC(=C(C=C1)C(=O)OCCCN2CCCCC2)O.Cl.Cl |
Product Overview
Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride (CAS 102338-95-4), with molecular formula C19H32Cl2N2O3 and molecular weight 406.18 g/mol. IUPAC: 3-piperidin-1-ylpropyl 4-(butylamino)-2-hydroxybenzoate;dihydrochloride.
Chemical Property Profile of Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride
Property Insights of Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride
The XLogP value of 4.4806 indicates that Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride. Following Lipinski's Rule of Five, Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride has 2 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 Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride?
The CAS number of Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride is 102338-95-4.
What is the molecular formula of Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride?
The molecular formula of Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride is C19H32Cl2N2O3.
What is the molecular weight of Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride?
The molecular weight of Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride is 406.18 g/mol.
Where can I buy Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride?
You can request a quote for Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Salicylic acid, 4-butylamino-, 3-piperidinopropyl ester, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.