ChemDiv1_014145
TL;DR: ChemDiv1_014145 (CAS 688356-45-8) is a chemical compound with molecular formula C26H27N5O5S2 and molecular weight 553.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Also Known As: ChemDiv1_014145, 2-({4-[(3,5-dimethoxyphenyl)amino]quinazolin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide, F6548-4739, 2-((4-((3,5-dimethoxyphenyl)amino)quinazolin-2-yl)thio)-N-(4-sulfamoylphenethyl)acetamide, 2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
| Molecular Formula | C26H27N5O5S2 |
|---|---|
| Molecular Weight | 553.15 g/mol |
| LogP | 3.489 |
| Topological Polar Surface Area | 145.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 553.1454 |
| Heavy Atoms | 38 |
| Complexity | 1523.7142 |
Chemical Identifiers
| CAS Number | 688356-45-8 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)NC2=NC(=NC3=CC=CC=C32)SCC(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N)OC |
Product Overview
ChemDiv1_014145 (CAS 688356-45-8), with molecular formula C26H27N5O5S2 and molecular weight 553.15 g/mol. IUPAC: 2-[4-(3,5-dimethoxyanilino)quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.
Chemical Property Profile of ChemDiv1_014145
Property Insights of ChemDiv1_014145
The XLogP value of 3.489 indicates that ChemDiv1_014145 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.53 Ų indicates high polarity, suggesting ChemDiv1_014145 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ChemDiv1_014145 has 3 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_014145?
The CAS number of ChemDiv1_014145 is 688356-45-8.
What is the molecular formula of ChemDiv1_014145?
The molecular formula of ChemDiv1_014145 is C26H27N5O5S2.
What is the molecular weight of ChemDiv1_014145?
The molecular weight of ChemDiv1_014145 is 553.15 g/mol.
Where can I buy ChemDiv1_014145?
You can request a quote for ChemDiv1_014145 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014145?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014145 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.