RefChem:233511
TL;DR: RefChem:233511 (CAS 101976-03-8) is a chemical compound with molecular formula C25H32Cl3N5O2 and molecular weight 539.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[(7-chloroquinolin-4-yl)amino]-2-methoxyphenyl]methyl]-N-ethyl-4-methylpiperazine-1-carboxamide;dihydrochloride
Also Known As: 1-Piperazinecarboxamide, N-(5-(7-chloro-4-quinolylamino)-2-methoxybenzyl)-N-ethyl-4-methyl-, dihydrochloride, N-({5-[(7-Chloroquinolin-4-yl)amino]-2-methoxyphenyl}methyl)-N-ethyl-4-methylpiperazine-1-carboxamide--hydrogen chloride (1/2), N-[[5-[(7-chloroquinolin-4-yl)amino]-2-methoxyphenyl]methyl]-N-ethyl-4-methylpiperazine-1-carboxamide dihydrochloride, RefChem:233511
| Molecular Formula | C25H32Cl3N5O2 |
|---|---|
| Molecular Weight | 539.16 g/mol |
| LogP | 5.6733 |
| Topological Polar Surface Area | 60.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 539.1622 |
| Heavy Atoms | 35 |
| Complexity | 1139.2854 |
Chemical Identifiers
| CAS Number | 101976-03-8 |
|---|---|
| SMILES | CCN(CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)OC)C(=O)N4CCN(CC4)C.Cl.Cl |
Product Overview
RefChem:233511 (CAS 101976-03-8), with molecular formula C25H32Cl3N5O2 and molecular weight 539.16 g/mol. IUPAC: N-[[5-[(7-chloroquinolin-4-yl)amino]-2-methoxyphenyl]methyl]-N-ethyl-4-methylpiperazine-1-carboxamide;dihydrochloride.
Chemical Property Profile of RefChem:233511
Property Insights of RefChem:233511
The XLogP value of 5.6733 indicates that RefChem:233511 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.94 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:233511. Following Lipinski's Rule of Five, RefChem:233511 has 1 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:233511?
The CAS number of RefChem:233511 is 101976-03-8.
What is the molecular formula of RefChem:233511?
The molecular formula of RefChem:233511 is C25H32Cl3N5O2.
What is the molecular weight of RefChem:233511?
The molecular weight of RefChem:233511 is 539.16 g/mol.
Where can I buy RefChem:233511?
You can request a quote for RefChem:233511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:233511?
Yes, KEHONG BIO provides custom synthesis services for RefChem:233511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.