RefChem:1056376
TL;DR: RefChem:1056376 (CAS 37652-90-7) is a chemical compound with molecular formula C29H30ClN3O4 and molecular weight 519.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[4-[(2-benzylphenyl)methyl]piperazin-1-yl]-1-(4-chlorophenyl)methanimine;(E)-but-2-enedioic acid
Also Known As: N-((4-Chlorophenyl)methylene)-4-((2-(phenylmethyl)phenyl)methyl)-1-piperazinamine maleate, 1-Piperazinamine, N-((4-chlorophenyl)methylene)-4-((2-(phenylmethyl)phenyl)methyl)-, (Z)-2-butenedioate (1:1), RefChem:1056376
| Molecular Formula | C29H30ClN3O4 |
|---|---|
| Molecular Weight | 519.19 g/mol |
| LogP | 4.7943 |
| Topological Polar Surface Area | 93.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 519.1925 |
| Heavy Atoms | 37 |
| Complexity | 1189.336 |
Chemical Identifiers
| CAS Number | 37652-90-7 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2CC3=CC=CC=C3)/N=C/C4=CC=C(C=C4)Cl.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1056376 (CAS 37652-90-7), with molecular formula C29H30ClN3O4 and molecular weight 519.19 g/mol. IUPAC: (E)-N-[4-[(2-benzylphenyl)methyl]piperazin-1-yl]-1-(4-chlorophenyl)methanimine;(E)-but-2-enedioic acid.
Chemical Property Profile of RefChem:1056376
Property Insights of RefChem:1056376
The XLogP value of 4.7943 indicates that RefChem:1056376 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.44 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1056376. Following Lipinski's Rule of Five, RefChem:1056376 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1056376?
The CAS number of RefChem:1056376 is 37652-90-7.
What is the molecular formula of RefChem:1056376?
The molecular formula of RefChem:1056376 is C29H30ClN3O4.
What is the molecular weight of RefChem:1056376?
The molecular weight of RefChem:1056376 is 519.19 g/mol.
Where can I buy RefChem:1056376?
You can request a quote for RefChem:1056376 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056376?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056376 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.