RefChem:217399
TL;DR: RefChem:217399 (CAS 7181-26-2) is a chemical compound with molecular formula C22H26ClN7 and molecular weight 423.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-(4-chlorophenyl)-6-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-1,3,5-triazine-2,4-diamine
Also Known As: 1,3,5-Triazine-2,4-diamine, N-(4-chlorophenyl)-6-(2-(4-(4-methylphenyl)-1-piperazinyl)ethyl)-, N-(4-Chlorophenyl)-6-(2-(4-(4-methylphenyl)-1-piperazinyl)ethyl)-1,3,5-triazine-2,4-diamine, 2-N-(4-chlorophenyl)-6-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-1,3,5-triazine-2,4-diamine, N~2~-(4-Chlorophenyl)-6-{2-[4-(4-methylphenyl)piperazin-1-yl]ethyl}-1,3,5-triazine-2,4-diamine, BRN 0633099
| Molecular Formula | C22H26ClN7 |
|---|---|
| Molecular Weight | 423.19 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.19382 |
| Heavy Atoms | 30 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 7181-26-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CCN(CC2)CCC3=NC(=NC(=N3)NC4=CC=C(C=C4)Cl)N |
| InChIKey | DWQZFQFABADWHV-UHFFFAOYSA-N |
Product Overview
RefChem:217399 (CAS 7181-26-2), with molecular formula C22H26ClN7 and molecular weight 423.19 g/mol. IUPAC: 2-N-(4-chlorophenyl)-6-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]-1,3,5-triazine-2,4-diamine.
Chemical Property Profile of RefChem:217399
Property Insights of RefChem:217399
The XLogP value of 4.4 indicates that RefChem:217399 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:217399. Following Lipinski's Rule of Five, RefChem:217399 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:217399?
The CAS number of RefChem:217399 is 7181-26-2.
What is the molecular formula of RefChem:217399?
The molecular formula of RefChem:217399 is C22H26ClN7.
What is the molecular weight of RefChem:217399?
The molecular weight of RefChem:217399 is 423.19 g/mol.
Where can I buy RefChem:217399?
You can request a quote for RefChem:217399 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:217399?
Yes, KEHONG BIO provides custom synthesis services for RefChem:217399 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.