RefChem:348267
TL;DR: RefChem:348267 (CAS 57227-97-1) is a chemical compound with molecular formula C36H51ClN4O10 and molecular weight 734.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[1-(dipropylamino)-3-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1-oxopropan-2-yl]benzamide;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: CR 725, Hydrocinnamamide, alpha-((p-chlorobenzoyl)amino)-N,N-dipropyl-4-(3-(4-methyl-1-piperazinyl)propoxy)-, citrate, (+-)-, O-(3-(N''-Methylpiperazine)-N'-propyl)-N-(p-chlorobenzoyl)-DL-tyrosyldi-n-propylamide citrate, 2-Hydroxypropane-1,2,3-tricarboxylic acid--Nalpha-(4-chlorobenzoyl)-O-[3-(4-methylpiperazin-1-yl)propyl]-N,N-dipropyltyrosinamide (1/1), 4-chloro-N-[1-(dipropylamino)-3-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1-oxopropan-2-yl]benzamide; 2-hydroxypropane-1,2,3-tricarboxylic acid
| Molecular Formula | C36H51ClN4O10 |
|---|---|
| Molecular Weight | 734.33 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 19 |
| Exact Mass | 734.32935 |
| Heavy Atoms | 51 |
| Complexity | 908.0 |
Chemical Identifiers
| CAS Number | 57227-97-1 |
|---|---|
| SMILES | CCCN(CCC)C(=O)C(CC1=CC=C(C=C1)OCCCN2CCN(CC2)C)NC(=O)C3=CC=C(C=C3)Cl.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | LFNRYYJKYBWVAN-UHFFFAOYSA-N |
Product Overview
RefChem:348267 (CAS 57227-97-1), with molecular formula C36H51ClN4O10 and molecular weight 734.33 g/mol. IUPAC: 4-chloro-N-[1-(dipropylamino)-3-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-1-oxopropan-2-yl]benzamide;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of RefChem:348267
Property Insights of RefChem:348267
The XLogP value of 3.1 indicates that RefChem:348267 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 197.0 Ų indicates high polarity, suggesting RefChem:348267 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:348267 has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:348267?
The CAS number of RefChem:348267 is 57227-97-1.
What is the molecular formula of RefChem:348267?
The molecular formula of RefChem:348267 is C36H51ClN4O10.
What is the molecular weight of RefChem:348267?
The molecular weight of RefChem:348267 is 734.33 g/mol.
Where can I buy RefChem:348267?
You can request a quote for RefChem:348267 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:348267?
Yes, KEHONG BIO provides custom synthesis services for RefChem:348267 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.