2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-
TL;DR: 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- (CAS 6521-48-8) is a chemical compound with molecular formula C20H19N3O2 and molecular weight 333.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione
Also Known As: Isorugulosuvine, Rugulosuvine, Cyclo(-Phe-Trp), Cyclo(-L-Phe-L-Trp), 3-benzyl-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione
| Molecular Formula | C20H19N3O2 |
|---|---|
| Molecular Weight | 333.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.14774 |
| Heavy Atoms | 25 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 6521-48-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2C(=O)NC(C(=O)N2)CC3=CNC4=CC=CC=C43 |
| InChIKey | CUVKAUWOMPJEMI-UHFFFAOYSA-N |
Product Overview
2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- (CAS 6521-48-8), with molecular formula C20H19N3O2 and molecular weight 333.15 g/mol. IUPAC: 3-benzyl-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione.
Chemical Property Profile of 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-
Property Insights of 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-. Following Lipinski's Rule of Five, 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- has 3 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 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-?
The CAS number of 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- is 6521-48-8.
What is the molecular formula of 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-?
The molecular formula of 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- is C20H19N3O2.
What is the molecular weight of 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-?
The molecular weight of 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- is 333.15 g/mol.
Where can I buy 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-?
You can request a quote for 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Piperazinedione, 3-(1H-indol-3-ylmethyl)-6-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.