RefChem:326841
TL;DR: RefChem:326841 (CAS 129229-94-3) is a chemical compound with molecular formula C32H35ClN2O10 and molecular weight 642.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl 2-chlorobenzoate
Also Known As: 2-phenoxymethyl-5-nitrobenzoic acid, (1,4-Bis(3,4,5-trimethoxybenzoyl)-2-piperazinyl)methyl 2-chlorobenzoate, N,N'-Di-(3',4',5'-trimethoxybenzoyl)-2-ortho-chlorobenzoyloxymethylpiperazine, Benzoic acid, 2-chloro-, (1,4-bis(3,4,5-trimethoxybenzoyl)-2-piperazinyl)methyl ester, [1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl 2-chlorobenzoate
| Molecular Formula | C32H35ClN2O10 |
|---|---|
| Molecular Weight | 642.20 g/mol |
| LogP | 4.2154 |
| Topological Polar Surface Area | 122.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 642.198 |
| Heavy Atoms | 45 |
| Complexity | 1512.6423 |
Chemical Identifiers
| CAS Number | 129229-94-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(C(C2)COC(=O)C3=CC=CC=C3Cl)C(=O)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
RefChem:326841 (CAS 129229-94-3), with molecular formula C32H35ClN2O10 and molecular weight 642.20 g/mol. IUPAC: [1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl 2-chlorobenzoate.
Chemical Property Profile of RefChem:326841
Property Insights of RefChem:326841
The XLogP value of 4.2154 indicates that RefChem:326841 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:326841. Following Lipinski's Rule of Five, RefChem:326841 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:326841?
The CAS number of RefChem:326841 is 129229-94-3.
What is the molecular formula of RefChem:326841?
The molecular formula of RefChem:326841 is C32H35ClN2O10.
What is the molecular weight of RefChem:326841?
The molecular weight of RefChem:326841 is 642.20 g/mol.
Where can I buy RefChem:326841?
You can request a quote for RefChem:326841 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:326841?
Yes, KEHONG BIO provides custom synthesis services for RefChem:326841 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.