(3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one
TL;DR: (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one (CAS 32897-61-3) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-(1-acetylindol-3-yl)but-3-en-2-one
Also Known As: (Z)-4-(1-acetylindol-3-yl)but-3-en-2-one, (Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one, (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one
| Molecular Formula | C14H13NO2 |
|---|---|
| Molecular Weight | 227.09 g/mol |
| LogP | 2.9036 |
| Topological Polar Surface Area | 39.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.09464 |
| Heavy Atoms | 17 |
| Complexity | 620.18396 |
Chemical Identifiers
| CAS Number | 32897-61-3 |
|---|---|
| SMILES | CC(=O)/C=C\C1=CN(C2=CC=CC=C21)C(=O)C |
Product Overview
(3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one (CAS 32897-61-3), with molecular formula C14H13NO2 and molecular weight 227.09 g/mol. IUPAC: (Z)-4-(1-acetylindol-3-yl)but-3-en-2-one.
Chemical Property Profile of (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one
Property Insights of (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one
The XLogP value of 2.9036 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one. With a topological polar surface area (TPSA) of 39.07 Ų, (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-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 (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one?
The CAS number of (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one is 32897-61-3.
What is the molecular formula of (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one?
The molecular formula of (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one is C14H13NO2.
What is the molecular weight of (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one?
The molecular weight of (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one is 227.09 g/mol.
Where can I buy (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one?
You can request a quote for (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-4-(1-acetyl-1H-indol-3-yl)but-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.