1,3-Di(2-oxoindolin-3-ylidene)acetone
TL;DR: 1,3-Di(2-oxoindolin-3-ylidene)acetone (CAS 21905-77-1) is a chemical compound with molecular formula C19H12N2O3 and molecular weight 316.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-oxo-3-(2-oxo-1H-indol-3-ylidene)propylidene]-1H-indol-2-one
Also Known As: 1,3-di(2-oxoindolin-3-ylidene)acetone, (3E)-3-[(3Z)-2-oxo-3-(2-oxo-1H-indol-3-ylidene)propylidene]-, 3-[2-oxo-3-(2-oxo-1H-indol-3-ylidene)propylidene]-1H-indol-2-one
| Molecular Formula | C19H12N2O3 |
|---|---|
| Molecular Weight | 316.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.08478 |
| Heavy Atoms | 24 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 21905-77-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=O)C=C3C4=CC=CC=C4NC3=O)C(=O)N2 |
| InChIKey | VBCWZUFGYNWZTE-UHFFFAOYSA-N |
Product Overview
1,3-Di(2-oxoindolin-3-ylidene)acetone (CAS 21905-77-1), with molecular formula C19H12N2O3 and molecular weight 316.08 g/mol. IUPAC: 3-[2-oxo-3-(2-oxo-1H-indol-3-ylidene)propylidene]-1H-indol-2-one.
Chemical Property Profile of 1,3-Di(2-oxoindolin-3-ylidene)acetone
Property Insights of 1,3-Di(2-oxoindolin-3-ylidene)acetone
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Di(2-oxoindolin-3-ylidene)acetone. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Di(2-oxoindolin-3-ylidene)acetone. Following Lipinski's Rule of Five, 1,3-Di(2-oxoindolin-3-ylidene)acetone has 2 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-Di(2-oxoindolin-3-ylidene)acetone?
The CAS number of 1,3-Di(2-oxoindolin-3-ylidene)acetone is 21905-77-1.
What is the molecular formula of 1,3-Di(2-oxoindolin-3-ylidene)acetone?
The molecular formula of 1,3-Di(2-oxoindolin-3-ylidene)acetone is C19H12N2O3.
What is the molecular weight of 1,3-Di(2-oxoindolin-3-ylidene)acetone?
The molecular weight of 1,3-Di(2-oxoindolin-3-ylidene)acetone is 316.08 g/mol.
Where can I buy 1,3-Di(2-oxoindolin-3-ylidene)acetone?
You can request a quote for 1,3-Di(2-oxoindolin-3-ylidene)acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Di(2-oxoindolin-3-ylidene)acetone?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Di(2-oxoindolin-3-ylidene)acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.