J1.616.809B
TL;DR: J1.616.809B (CAS 30360-29-3) is a chemical compound with molecular formula C9H3Cl9N6O3 and molecular weight 557.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4,6-bis[(2,2,2-trichloroacetyl)amino]-1,3,5-triazin-2-yl]-2,2,2-trichloroacetamide
Also Known As: J1.616.809B, N-[4,6-bis[(2,2,2-trichloroacetyl)amino]-1,3,5-triazin-2-yl]-2,2,2-trichloroacetamide, N,N',N''-S-TRIAZINE-2,4,6-TRIYLTRIS(2,2,2-TRI*), N,N ,N -s-Triazine-2,4,6-triyltris(2,2,2-trichloroacetamide), N,N',N''-(1,3,5-Triazine-2,4,6-triyl)tris(2,2,2-trichloroacetamide)
| Molecular Formula | C9H3Cl9N6O3 |
|---|---|
| Molecular Weight | 557.75 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 561.7404 |
| Heavy Atoms | 27 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 30360-29-3 |
|---|---|
| SMILES | C1(=NC(=NC(=N1)NC(=O)C(Cl)(Cl)Cl)NC(=O)C(Cl)(Cl)Cl)NC(=O)C(Cl)(Cl)Cl |
| InChIKey | MLTYEYHGKAQIFG-UHFFFAOYSA-N |
Product Overview
J1.616.809B (CAS 30360-29-3), with molecular formula C9H3Cl9N6O3 and molecular weight 557.75 g/mol. IUPAC: N-[4,6-bis[(2,2,2-trichloroacetyl)amino]-1,3,5-triazin-2-yl]-2,2,2-trichloroacetamide.
Chemical Property Profile of J1.616.809B
Property Insights of J1.616.809B
The XLogP value of 4.1 indicates that J1.616.809B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.616.809B. Following Lipinski's Rule of Five, J1.616.809B has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J1.616.809B?
The CAS number of J1.616.809B is 30360-29-3.
What is the molecular formula of J1.616.809B?
The molecular formula of J1.616.809B is C9H3Cl9N6O3.
What is the molecular weight of J1.616.809B?
The molecular weight of J1.616.809B is 557.75 g/mol.
Where can I buy J1.616.809B?
You can request a quote for J1.616.809B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.616.809B?
Yes, KEHONG BIO provides custom synthesis services for J1.616.809B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.