RefChem:233510
TL;DR: RefChem:233510 (CAS 101976-04-9) is a chemical compound with molecular formula C23H28Cl3N5O2 and molecular weight 511.13086 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[5-[(7-chloroquinolin-4-yl)amino]-2-methoxyphenyl]methyl]-4-methylpiperazine-1-carboxamide;dihydrochloride
Also Known As: 1-Piperazinecarboxamide, N-(5-(7-chloro-4-quinolylamino)-2-methoxybenzyl)-4-methyl-, dihydrochloride, N-({5-[(7-Chloroquinolin-4-yl)amino]-2-methoxyphenyl}methyl)-4-methylpiperazine-1-carboxamide--hydrogen chloride (1/2), N-[[5-[(7-chloroquinolin-4-yl)amino]-2-methoxyphenyl]methyl]-4-methylpiperazine-1-carboxamide dihydrochloride
Technical Specifications
| Molecular Formula | C23H28Cl3N5O2 |
| Molecular Weight | 511.13086 g/mol |
| XLogP | 4.941 |
| Topological Polar Surface Area (TPSA) | 69.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 511.13086 Da |
| Heavy Atoms | 33 |
| Complexity | 588.0 |
| SMILES | CN1CCN(CC1)C(=O)NCC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)OC.Cl.Cl |
| InChIKey | XSSNKUKGETXNNJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:233510
Property Insights of RefChem:233510
The XLogP value of 4.941 indicates that RefChem:233510 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:233510. Following Lipinski's Rule of Five, RefChem:233510 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:233510?
The CAS number of RefChem:233510 is 101976-04-9.
What is the molecular formula of RefChem:233510?
The molecular formula of RefChem:233510 is C23H28Cl3N5O2.
What is the molecular weight of RefChem:233510?
The molecular weight of RefChem:233510 is 511.13086 g/mol.
Where can I buy RefChem:233510?
You can request a quote for RefChem:233510 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:233510?
Yes, CoreyChem provides custom synthesis services for RefChem:233510 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.