1,4-二(1-吲哚基)丁烷
TL;DR: 1,4-二(1-吲哚基)丁烷 (CAS 94545-16-1) is a chemical compound with molecular formula C20H20N2 and molecular weight 288.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-二(1-吲哚基)丁烷
1-(4-indol-1-ylbutyl)indole
Also Known As: 1-(4-indol-1-ylbutyl)indole, Penfluridol Impurity 15, 1,4-di(indol-1-yl)butane, Butane, 1,4-di(1-indolyl)-, 1,4-Bis-(indol-1-yl)-butane
| Molecular Formula | C20H20N2 |
|---|---|
| Molecular Weight | 288.16 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 9.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.16266 |
| Heavy Atoms | 22 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 94545-16-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN2CCCCN3C=CC4=CC=CC=C43 |
| InChIKey | IYTCVCIPYHQQPJ-UHFFFAOYSA-N |
Product Overview
1,4-二(1-吲哚基)丁烷 (CAS 94545-16-1), with molecular formula C20H20N2 and molecular weight 288.16 g/mol. IUPAC: 1-(4-indol-1-ylbutyl)indole.
Chemical Property Profile of 1,4-二(1-吲哚基)丁烷
Property Insights of 1,4-二(1-吲哚基)丁烷
The XLogP value of 4.4 indicates that 1,4-二(1-吲哚基)丁烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.9 Ų, 1,4-二(1-吲哚基)丁烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-二(1-吲哚基)丁烷 has 0 hydrogen bond donor(s) and 0 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 1,4-二(1-吲哚基)丁烷?
The CAS number of 1,4-二(1-吲哚基)丁烷 is 94545-16-1.
What is the molecular formula of 1,4-二(1-吲哚基)丁烷?
The molecular formula of 1,4-二(1-吲哚基)丁烷 is C20H20N2.
What is the molecular weight of 1,4-二(1-吲哚基)丁烷?
The molecular weight of 1,4-二(1-吲哚基)丁烷 is 288.16 g/mol.
Where can I buy 1,4-二(1-吲哚基)丁烷?
You can request a quote for 1,4-二(1-吲哚基)丁烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-二(1-吲哚基)丁烷?
Yes, KEHONG BIO provides custom synthesis services for 1,4-二(1-吲哚基)丁烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.