2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-
TL;DR: 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)- (CAS 57287-86-2) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-6-(hydroxymethyl)piperazine-2,5-dione
Also Known As: CYCLO(-PHE-SER), Cyclo(-L-Phe-L-Ser), 3-benzyl-6-(hydroxymethyl)piperazine-2,5-dione, (3S,6S)-3-benzyl-6-(hydroxymethyl)piperazine-2,5-dione, 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-
| Molecular Formula | C12H14N2O3 |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.10045 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 57287-86-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2C(=O)NC(C(=O)N2)CO |
| InChIKey | WIJKWEYCUNYTGY-UHFFFAOYSA-N |
Product Overview
2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)- (CAS 57287-86-2), with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol. IUPAC: 3-benzyl-6-(hydroxymethyl)piperazine-2,5-dione.
Chemical Property Profile of 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-
Property Insights of 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-. Following Lipinski's Rule of Five, 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)- has 3 hydrogen bond donor(s) and 3 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-(hydroxymethyl)-6-(phenylmethyl)-?
The CAS number of 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)- is 57287-86-2.
What is the molecular formula of 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-?
The molecular formula of 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)- is C12H14N2O3.
What is the molecular weight of 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-?
The molecular weight of 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)- is 234.10 g/mol.
Where can I buy 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)-?
You can request a quote for 2,5-Piperazinedione, 3-(hydroxymethyl)-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-(hydroxymethyl)-6-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Piperazinedione, 3-(hydroxymethyl)-6-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.