Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester
TL;DR: Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester (CAS 73713-50-5) is a chemical compound with molecular formula C17H28N2O2 and molecular weight 292.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(heptan-4-ylamino)propan-2-yl 4-aminobenzoate
Also Known As: p-Aminobenzoic acid 1-(4-heptylamino)-2-propyl ester, 1-(heptan-4-ylamino)propan-2-yl 4-aminobenzoate, 1-[(Heptan-4-yl)amino]propan-2-yl 4-aminobenzoate, BENZOIC ACID, p-AMINO-, 1-(4-HEPTYLAMINO)-2-PROPYL ESTER, 2-(1-Propylbutylamino)-1-methylethyl=p-aminobenzoate
| Molecular Formula | C17H28N2O2 |
|---|---|
| Molecular Weight | 292.22 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 292.2151 |
| Heavy Atoms | 21 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 73713-50-5 |
|---|---|
| SMILES | CCCC(CCC)NCC(C)OC(=O)C1=CC=C(C=C1)N |
| InChIKey | MCSFKWJOXYUHRW-UHFFFAOYSA-N |
Product Overview
Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester (CAS 73713-50-5), with molecular formula C17H28N2O2 and molecular weight 292.22 g/mol. IUPAC: 1-(heptan-4-ylamino)propan-2-yl 4-aminobenzoate.
Chemical Property Profile of Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester
Property Insights of Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester
The XLogP value of 3.7 indicates that Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester. Following Lipinski's Rule of Five, Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester has 2 hydrogen bond donor(s) and 4 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 Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester?
The CAS number of Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester is 73713-50-5.
What is the molecular formula of Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester?
The molecular formula of Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester is C17H28N2O2.
What is the molecular weight of Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester?
The molecular weight of Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester is 292.22 g/mol.
Where can I buy Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester?
You can request a quote for Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, p-amino-, 1-(4-heptylamino)-2-propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.