1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one
TL;DR: 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one (CAS 7492-68-4) is a chemical compound with molecular formula C14H17NO and molecular weight 215.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3,3-trimethylindol-2-ylidene)propan-2-one
Also Known As: 1-(1,3,3-trimethylindol-2-ylidene)propan-2-one, 1-(1,3,3-trimethyl-2,3-dihydro-1h-indol-2-yliden)acetone
| Molecular Formula | C14H17NO |
|---|---|
| Molecular Weight | 215.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.13101 |
| Heavy Atoms | 16 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 7492-68-4 |
|---|---|
| SMILES | CC(=O)C=C1C(C2=CC=CC=C2N1C)(C)C |
| InChIKey | OASCYHRIQHKJKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one (CAS 7492-68-4), with molecular formula C14H17NO and molecular weight 215.13 g/mol. IUPAC: 1-(1,3,3-trimethylindol-2-ylidene)propan-2-one.
Chemical Property Profile of 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one
Property Insights of 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one has 0 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-(1,3,3-Trimethylindol-2-ylidene)propan-2-one?
The CAS number of 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one is 7492-68-4.
What is the molecular formula of 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one?
The molecular formula of 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one is C14H17NO.
What is the molecular weight of 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one?
The molecular weight of 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one is 215.13 g/mol.
Where can I buy 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one?
You can request a quote for 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3,3-Trimethylindol-2-ylidene)propan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.