ChemDiv1_006731
TL;DR: ChemDiv1_006731 (CAS 361193-41-1) is a chemical compound with molecular formula C29H25N7O3S2 and molecular weight 583.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide
Also Known As: ChemDiv1_006731, N-(4-{[(4,6-DIMETHYL-2-PYRIMIDINYL)AMINO]SULFONYL}PHENYL)-2-[(5,6-DIPHENYL-1,2,4-TRIAZIN-3-YL)SULFANYL]ACETAMIDE, N-(4-{[(4,6-dimethyl-2-pyrimidinyl)amino]sulfonyl}phenyl)-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)thio]acetamide, N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide, 648-955-8
| Molecular Formula | C29H25N7O3S2 |
|---|---|
| Molecular Weight | 583.15 g/mol |
| LogP | 5.14404 |
| Topological Polar Surface Area | 139.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 583.14606 |
| Heavy Atoms | 41 |
| Complexity | 1765.2303 |
Chemical Identifiers
| CAS Number | 361193-41-1 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC(=C(N=N3)C4=CC=CC=C4)C5=CC=CC=C5)C |
Product Overview
ChemDiv1_006731 (CAS 361193-41-1), with molecular formula C29H25N7O3S2 and molecular weight 583.15 g/mol. IUPAC: N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-2-[(5,6-diphenyl-1,2,4-triazin-3-yl)sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_006731
Property Insights of ChemDiv1_006731
The XLogP value of 5.14404 indicates that ChemDiv1_006731 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.72 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_006731. Following Lipinski's Rule of Five, ChemDiv1_006731 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_006731?
The CAS number of ChemDiv1_006731 is 361193-41-1.
What is the molecular formula of ChemDiv1_006731?
The molecular formula of ChemDiv1_006731 is C29H25N7O3S2.
What is the molecular weight of ChemDiv1_006731?
The molecular weight of ChemDiv1_006731 is 583.15 g/mol.
Where can I buy ChemDiv1_006731?
You can request a quote for ChemDiv1_006731 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_006731?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_006731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.