2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione
TL;DR: 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione (CAS 28752-91-2) is a chemical compound with molecular formula C12H11NO2 and molecular weight 201.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylaminomethylidene)indene-1,3-dione
Also Known As: 2-[(dimethylamino)methylene]-1H-indene-1,3(2H)-dione, 2-(dimethylaminomethylidene)indene-1,3-dione, 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione, Dimethylaminomethylene-2 indanedione-1,3, 1H-Indene-1,3(2H)-dione, 2-((dimethylamino)methylene)-
| Molecular Formula | C12H11NO2 |
|---|---|
| Molecular Weight | 201.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.07898 |
| Heavy Atoms | 15 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 28752-91-2 |
|---|---|
| SMILES | CN(C)C=C1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | MVUJXFMCAICFMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione (CAS 28752-91-2), with molecular formula C12H11NO2 and molecular weight 201.08 g/mol. IUPAC: 2-(dimethylaminomethylidene)indene-1,3-dione.
Chemical Property Profile of 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione
Property Insights of 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione. With a topological polar surface area (TPSA) of 37.4 Ų, 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione has 0 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 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione?
The CAS number of 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione is 28752-91-2.
What is the molecular formula of 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione?
The molecular formula of 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione is C12H11NO2.
What is the molecular weight of 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione?
The molecular weight of 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione is 201.08 g/mol.
Where can I buy 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione?
You can request a quote for 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-((Dimethylamino)methylene)-1H-indene-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.