1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)
TL;DR: 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) (CAS 68967-00-0) is a chemical compound with molecular formula C28H27NO2 and molecular weight 409.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethylphenyl)-1-[1-[2-(3,4-dimethylphenyl)acetyl]indol-3-yl]ethanone
Also Known As: KST-1B7542, EINECS 273-464-7, C9H12.1/2Al2Cl7.1/2H, C9-H12.1/2Al2-Cl7.1/2H, Indole, 1,3-bis(3,4-xylylacetyl)- (7CI,8CI)
| Molecular Formula | C28H27NO2 |
|---|---|
| Molecular Weight | 409.20 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 39.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.2042 |
| Heavy Atoms | 31 |
| Complexity | 645.0 |
Chemical Identifiers
| CAS Number | 68967-00-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)CC(=O)C2=CN(C3=CC=CC=C32)C(=O)CC4=CC(=C(C=C4)C)C)C |
| InChIKey | DANBXGPFZDXPDQ-UHFFFAOYSA-N |
Product Overview
1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) (CAS 68967-00-0), with molecular formula C28H27NO2 and molecular weight 409.20 g/mol. IUPAC: 2-(3,4-dimethylphenyl)-1-[1-[2-(3,4-dimethylphenyl)acetyl]indol-3-yl]ethanone.
Chemical Property Profile of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)
Property Insights of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)
The XLogP value of 6.2 indicates that 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.1 Ų, 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)?
The CAS number of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) is 68967-00-0.
What is the molecular formula of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)?
The molecular formula of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) is C28H27NO2.
What is the molecular weight of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)?
The molecular weight of 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) is 409.20 g/mol.
Where can I buy 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)?
You can request a quote for 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(1H-Indole-1,3-diyl)bis(2-(3,4-dimethylphenyl)ethanone) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.