3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile
TL;DR: 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile (CAS 891138-13-9) is a chemical compound with molecular formula C17H17N3S and molecular weight 295.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile
Also Known As: 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile, 3-(4-aminobutyl)-2-(thiophen-2-yl)-1h-indole-5-carbonitrile
| Molecular Formula | C17H17N3S |
|---|---|
| Molecular Weight | 295.11 g/mol |
| LogP | 4.04948 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.11432 |
| Heavy Atoms | 21 |
| Complexity | 778.323 |
Chemical Identifiers
| CAS Number | 891138-13-9 |
|---|---|
| SMILES | C1=CSC(=C1)C2=C(C3=C(N2)C=CC(=C3)C#N)CCCCN |
Product Overview
3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile (CAS 891138-13-9), with molecular formula C17H17N3S and molecular weight 295.11 g/mol. IUPAC: 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile.
Chemical Property Profile of 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile
Property Insights of 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile
The XLogP value of 4.04948 indicates that 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile. Following Lipinski's Rule of Five, 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile has 2 hydrogen bond donor(s) and 3 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 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile?
The CAS number of 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile is 891138-13-9.
What is the molecular formula of 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile?
The molecular formula of 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile is C17H17N3S.
What is the molecular weight of 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile?
The molecular weight of 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile is 295.11 g/mol.
Where can I buy 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile?
You can request a quote for 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-aminobutyl)-2-thiophen-2-yl-1H-indole-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.