RefChem:1056465
TL;DR: RefChem:1056465 (CAS 37652-73-6) is a chemical compound with molecular formula C26H30N2O7 and molecular weight 482.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[(2-benzylphenyl)methyl]-2-oxopiperazin-1-yl]butanoic acid;(Z)-but-2-enedioic acid
Also Known As: C22H26N2O3.C4H4O4.1/2H2O, gamma-Oxo-4-((2-(phenylmethyl)phenyl)methyl)-1-piperazinebutanoic acid maleate hemihydrate, C22-H26-N2-O3.C4-H4-O4.1/2H2-O, 1-(2-Benzylbenzyl)-4-(3-carboxypropionyl)piperazine hydrogen maleate hemihydrate, 1-Piperazinebutanoic acid, gamma-oxo-4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate,hydrate (2:2:1)
| Molecular Formula | C26H30N2O7 |
|---|---|
| Molecular Weight | 482.21 g/mol |
| LogP | 2.4982 |
| Topological Polar Surface Area | 135.45 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 482.2053 |
| Heavy Atoms | 35 |
| Complexity | 1021.0056 |
Chemical Identifiers
| CAS Number | 37652-73-6 |
|---|---|
| SMILES | C1CN(C(=O)CN1CC2=CC=CC=C2CC3=CC=CC=C3)CCCC(=O)O.C(=C\C(=O)O)\C(=O)O |
Product Overview
RefChem:1056465 (CAS 37652-73-6), with molecular formula C26H30N2O7 and molecular weight 482.21 g/mol. IUPAC: 4-[4-[(2-benzylphenyl)methyl]-2-oxopiperazin-1-yl]butanoic acid;(Z)-but-2-enedioic acid.
Chemical Property Profile of RefChem:1056465
Property Insights of RefChem:1056465
The XLogP value of 2.4982 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056465. The TPSA of 135.45 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1056465. Following Lipinski's Rule of Five, RefChem:1056465 has 3 hydrogen bond donor(s) and 5 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 RefChem:1056465?
The CAS number of RefChem:1056465 is 37652-73-6.
What is the molecular formula of RefChem:1056465?
The molecular formula of RefChem:1056465 is C26H30N2O7.
What is the molecular weight of RefChem:1056465?
The molecular weight of RefChem:1056465 is 482.21 g/mol.
Where can I buy RefChem:1056465?
You can request a quote for RefChem:1056465 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056465?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056465 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.