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F0072-0409 structure
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F0072-0409

TL;DR: F0072-0409 (CAS 391219-99-1) is a chemical compound with molecular formula C26H32N6O6S2 and molecular weight 588.1825 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]-1-(4-methylphenyl)sulfonyl-1-pentylurea

Also Known As: F0072-0409, 1-[({4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}carbamoyl)amino]-N-(4-methylbenzenesulfonyl)-N-pentylformamide, 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]-1-(4-methylphenyl)sulfonyl-1-pentylurea, N-(((4-(N-(4,6-dimethylpyrimidin-2-yl)sulfamoyl)phenyl)carbamoyl)carbamoyl)-4-methyl-N-pentylbenzenesulfonamide, (4,6-dimethyl-2-pyrimidinylamino)-p-{5-[oxido(oxo)-p-tolyl-lambda-sulfaniumyl]-5-pentylbiuretyl}phenyl(oxo)-lambda-sulfaniumolate

CAS Number
391219-99-1
Molecular Formula
C26H32N6O6S2
Molecular Weight
588.1825 g/mol
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Technical Specifications

Molecular FormulaC26H32N6O6S2
Molecular Weight588.1825 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)184.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors9
Rotatable Bonds10
Exact Mass588.1825 Da
Heavy Atoms40
Complexity1030.0
SMILESCCCCCN(C(=O)NC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)C)C)S(=O)(=O)C3=CC=C(C=C3)C
InChIKeyUOKBUUNZWVKYAG-UHFFFAOYSA-N

Chemical Property Profile of F0072-0409

XLogP
4.5
TPSA (Topological Polar Surface Area)
184.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
9
Rotatable Bonds
10
Heavy Atoms
40
Complexity
1030.0
Exact Mass
588.1825
Monoisotopic Mass
588.1825
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of F0072-0409

The XLogP value of 4.5 indicates that F0072-0409 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.0 Ų indicates high polarity, suggesting F0072-0409 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0072-0409 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of F0072-0409?

The CAS number of F0072-0409 is 391219-99-1.

What is the molecular formula of F0072-0409?

The molecular formula of F0072-0409 is C26H32N6O6S2.

What is the molecular weight of F0072-0409?

The molecular weight of F0072-0409 is 588.1825 g/mol.

Where can I buy F0072-0409?

You can request a quote for F0072-0409 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for F0072-0409?

Yes, CoreyChem provides custom synthesis services for F0072-0409 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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