3-(1H-indol-3-ylmethyl)piperazine-2,5-dione
TL;DR: 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione (CAS 52997-35-0) is a chemical compound with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-indol-3-ylmethyl)piperazine-2,5-dione
Also Known As: Cyclo(-Gly-Trp), Cyclo(glycyltryptophyl), Cyclic glycyl-L-tryptophan, Cyclo(glycyl-L-tryptophan), Cyclo(glycyl-L-tryptophyl)
| Molecular Formula | C13H13N3O2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.10077 |
| Heavy Atoms | 18 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 52997-35-0 |
|---|---|
| SMILES | C1C(=O)NC(C(=O)N1)CC2=CNC3=CC=CC=C32 |
| InChIKey | IFQZEERDQXQTLJ-UHFFFAOYSA-N |
Product Overview
3-(1H-indol-3-ylmethyl)piperazine-2,5-dione (CAS 52997-35-0), with molecular formula C13H13N3O2 and molecular weight 243.10 g/mol. IUPAC: 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione.
Chemical Property Profile of 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione
Property Insights of 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione. Following Lipinski's Rule of Five, 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione 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 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione?
The CAS number of 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione is 52997-35-0.
What is the molecular formula of 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione?
The molecular formula of 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione is C13H13N3O2.
What is the molecular weight of 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione?
The molecular weight of 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione is 243.10 g/mol.
Where can I buy 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione?
You can request a quote for 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-indol-3-ylmethyl)piperazine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.