N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide
TL;DR: N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide (CAS 30356-71-9) is a chemical compound with molecular formula C12H8Cl6N4O2S and molecular weight 481.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide
Also Known As: J1.612.791D, N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide, N-(4,6-BIS(TRICHLOROMETHYL)-S-TRIAZIN-2-YL)-P-*, N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzene-1-sulfonamide, N-[4,6-Bis(trichloromethyl)-s-triazine-2-yl]-4-methylbenzenesulfonamide
| Molecular Formula | C12H8Cl6N4O2S |
|---|---|
| Molecular Weight | 481.85 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 93.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 483.84695 |
| Heavy Atoms | 25 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 30356-71-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl |
| InChIKey | CBBOFVRXKCPJSO-UHFFFAOYSA-N |
Product Overview
N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide (CAS 30356-71-9), with molecular formula C12H8Cl6N4O2S and molecular weight 481.85 g/mol. IUPAC: N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide.
Chemical Property Profile of N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide
Property Insights of N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide
The XLogP value of 4.5 indicates that N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide has 1 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-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide?
The CAS number of N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide is 30356-71-9.
What is the molecular formula of N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide?
The molecular formula of N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide is C12H8Cl6N4O2S.
What is the molecular weight of N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide?
The molecular weight of N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide is 481.85 g/mol.
Where can I buy N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide?
You can request a quote for N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.