1,3-Indandione, 2-ethyl-2-(propylamino)-
TL;DR: 1,3-Indandione, 2-ethyl-2-(propylamino)- (CAS 59209-60-8) is a chemical compound with molecular formula C14H17NO2 and molecular weight 231.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-2-(propylamino)indene-1,3-dione
Also Known As: 1,3-Indandione, 2-ethyl-2-(propylamino)-, 2-Ethyl-2-(propylamino)-1,3-indandione, 2-ethyl-2-(propylamino)indene-1,3-dione, 2-Ethyl-2-(propylamino)-1H-indene-1,3(2H)-dione, RefChem:219318
| Molecular Formula | C14H17NO2 |
|---|---|
| Molecular Weight | 231.13 g/mol |
| LogP | 2.214 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.12593 |
| Heavy Atoms | 17 |
| Complexity | 430.04495 |
Chemical Identifiers
| CAS Number | 59209-60-8 |
|---|---|
| SMILES | CCCNC1(C(=O)C2=CC=CC=C2C1=O)CC |
Product Overview
1,3-Indandione, 2-ethyl-2-(propylamino)- (CAS 59209-60-8), with molecular formula C14H17NO2 and molecular weight 231.13 g/mol. IUPAC: 2-ethyl-2-(propylamino)indene-1,3-dione.
Chemical Property Profile of 1,3-Indandione, 2-ethyl-2-(propylamino)-
Property Insights of 1,3-Indandione, 2-ethyl-2-(propylamino)-
The XLogP value of 2.214 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Indandione, 2-ethyl-2-(propylamino)-. With a topological polar surface area (TPSA) of 46.17 Ų, 1,3-Indandione, 2-ethyl-2-(propylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Indandione, 2-ethyl-2-(propylamino)- has 1 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 1,3-Indandione, 2-ethyl-2-(propylamino)-?
The CAS number of 1,3-Indandione, 2-ethyl-2-(propylamino)- is 59209-60-8.
What is the molecular formula of 1,3-Indandione, 2-ethyl-2-(propylamino)-?
The molecular formula of 1,3-Indandione, 2-ethyl-2-(propylamino)- is C14H17NO2.
What is the molecular weight of 1,3-Indandione, 2-ethyl-2-(propylamino)-?
The molecular weight of 1,3-Indandione, 2-ethyl-2-(propylamino)- is 231.13 g/mol.
Where can I buy 1,3-Indandione, 2-ethyl-2-(propylamino)-?
You can request a quote for 1,3-Indandione, 2-ethyl-2-(propylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Indandione, 2-ethyl-2-(propylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Indandione, 2-ethyl-2-(propylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.