Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate
TL;DR: Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate (CAS 22445-73-4) is a chemical compound with molecular formula C17H24N2O4 and molecular weight 320.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;[3-(2-aminoethyl)-1H-indol-5-yl] pentanoate
Also Known As: Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate, 3-(2-Aminoethyl)indol-5-yl ester of valeric acid acetate, 3-(2-aminoethyl)-1h-indol-5-yl pentanoate acetate(1:1), acetic acid,[3-(2-aminoethyl)-1H-indol-5-yl] pentanoate, acetic acid; [3-(2-aminoethyl)-1H-indol-5-yl] pentanoate
| Molecular Formula | C17H24N2O4 |
|---|---|
| Molecular Weight | 320.17 g/mol |
| LogP | 2.8556 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 320.1736 |
| Heavy Atoms | 23 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 22445-73-4 |
|---|---|
| SMILES | CCCCC(=O)OC1=CC2=C(C=C1)NC=C2CCN.CC(=O)O |
| InChIKey | VZPMKHZSBJMJAR-UHFFFAOYSA-N |
Product Overview
Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate (CAS 22445-73-4), with molecular formula C17H24N2O4 and molecular weight 320.17 g/mol. IUPAC: acetic acid;[3-(2-aminoethyl)-1H-indol-5-yl] pentanoate.
Chemical Property Profile of Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate
Property Insights of Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate
The XLogP value of 2.8556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate. Following Lipinski's Rule of Five, Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate has 3 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 Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate?
The CAS number of Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate is 22445-73-4.
What is the molecular formula of Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate?
The molecular formula of Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate is C17H24N2O4.
What is the molecular weight of Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate?
The molecular weight of Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate is 320.17 g/mol.
Where can I buy Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate?
You can request a quote for Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate?
Yes, KEHONG BIO provides custom synthesis services for Valeric acid, 3-(2-aminoethyl)indol-5-yl ester, monoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.