3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione
TL;DR: 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione (CAS 55062-34-5) is a chemical compound with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethylidene-6-(1H-indol-3-ylmethyl)-1-methylpiperazine-2,5-dione
Also Known As: 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione
| Molecular Formula | C16H17N3O2 |
|---|---|
| Molecular Weight | 283.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.13208 |
| Heavy Atoms | 21 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 55062-34-5 |
|---|---|
| SMILES | CC=C1C(=O)N(C(C(=O)N1)CC2=CNC3=CC=CC=C32)C |
| InChIKey | LIHMCRDYZWJENE-UHFFFAOYSA-N |
Product Overview
3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione (CAS 55062-34-5), with molecular formula C16H17N3O2 and molecular weight 283.13 g/mol. IUPAC: 3-ethylidene-6-(1H-indol-3-ylmethyl)-1-methylpiperazine-2,5-dione.
Chemical Property Profile of 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione
Property Insights of 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione. Following Lipinski's Rule of Five, 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione has 2 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 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione?
The CAS number of 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione is 55062-34-5.
What is the molecular formula of 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione?
The molecular formula of 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione is C16H17N3O2.
What is the molecular weight of 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione?
The molecular weight of 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione is 283.13 g/mol.
Where can I buy 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione?
You can request a quote for 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethylidene-6-(1H-indol-3-ylmethyl)-1-methyl-2,5-piperazinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.