N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)
TL;DR: N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) (CAS 30360-27-1) is a chemical compound with molecular formula C9H9Cl3N6O3 and molecular weight 353.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4,6-bis[(2-chloroacetyl)amino]-1,3,5-triazin-2-yl]-2-chloroacetamide
Also Known As: J1.616.794K, N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide), Acetamide,N,N',N''-1,3,5-triazine-2,4,6-triyltris[2-chloro, Acetamide,n,n,n-1,3,5-triazine-2,4,6-triyltris[2-chloro-, N-[4,6-bis[(2-chloroacetyl)amino]-1,3,5-triazin-2-yl]-2-chloroacetamide
| Molecular Formula | C9H9Cl3N6O3 |
|---|---|
| Molecular Weight | 353.98 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.98016 |
| Heavy Atoms | 21 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 30360-27-1 |
|---|---|
| SMILES | C(C(=O)NC1=NC(=NC(=N1)NC(=O)CCl)NC(=O)CCl)Cl |
| InChIKey | YJJIEWIAKNUQIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) (CAS 30360-27-1), with molecular formula C9H9Cl3N6O3 and molecular weight 353.98 g/mol. IUPAC: N-[4,6-bis[(2-chloroacetyl)amino]-1,3,5-triazin-2-yl]-2-chloroacetamide.
Chemical Property Profile of N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)
Property Insights of N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide). The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide). Following Lipinski's Rule of Five, N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) has 3 hydrogen bond donor(s) and 6 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 N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)?
The CAS number of N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) is 30360-27-1.
What is the molecular formula of N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)?
The molecular formula of N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) is C9H9Cl3N6O3.
What is the molecular weight of N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)?
The molecular weight of N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) is 353.98 g/mol.
Where can I buy N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)?
You can request a quote for N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide)?
Yes, KEHONG BIO provides custom synthesis services for N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2-chloroacetamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.