1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-
TL;DR: 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- (CAS 123973-75-1) is a chemical compound with molecular formula C19H13NO2 and molecular weight 287.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methyl-1H-indol-3-yl)naphthalene-1,4-dione
Also Known As: 2-(2-methyl-1H-indol-3-yl)naphthalene-1,4-dione, 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-, 2-(2-methyl-1H-indol-3-yl)naphthoquinone, 2-(2-methyl-3-indolyl)-1,4-naphthoquinone, 2-(2-Methyl-1H-indole-3-yl)-1,4-naphthoquinone
| Molecular Formula | C19H13NO2 |
|---|---|
| Molecular Weight | 287.09 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 287.09464 |
| Heavy Atoms | 22 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 123973-75-1 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C3=CC(=O)C4=CC=CC=C4C3=O |
| InChIKey | WUJQCQKYMKWDSU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- (CAS 123973-75-1), with molecular formula C19H13NO2 and molecular weight 287.09 g/mol. IUPAC: 2-(2-methyl-1H-indol-3-yl)naphthalene-1,4-dione.
Chemical Property Profile of 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-
Property Insights of 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-
The XLogP value of 3.6 indicates that 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- has 1 hydrogen bond donor(s) and 2 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-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-?
The CAS number of 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- is 123973-75-1.
What is the molecular formula of 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-?
The molecular formula of 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- is C19H13NO2.
What is the molecular weight of 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-?
The molecular weight of 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- is 287.09 g/mol.
Where can I buy 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-?
You can request a quote for 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthalenedione, 2-(2-methyl-1H-indol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.