Home Sulfos 1-{[2-(2-chloroethoxy)benzene]sulfonyl}-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea

1-{[2-(2-chloroethoxy)benzene]sulfonyl}-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea

CAS No.:
82097-50-5
Catalog Number:
AG0039VO
Molecular Formula:
C14H16ClN5O5S
Molecular Weight:
401.8253
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%(HPLC)
In Stock USA
United States
$73
- +
1g
95%
In Stock USA
United States
$219
- +
5g
95%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG0039VO
Chemical Name:
1-{[2-(2-chloroethoxy)benzene]sulfonyl}-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
CAS Number:
82097-50-5
Molecular Formula:
C14H16ClN5O5S
Molecular Weight:
401.8253
MDL Number:
MFCD00145436
IUPAC Name:
1-[2-(2-chloroethoxy)phenyl]sulfonyl-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea
InChI:
InChI=1S/C14H16ClN5O5S/c1-9-16-12(19-14(17-9)24-2)18-13(21)20-26(22,23)11-6-4-3-5-10(11)25-8-7-15/h3-6H,7-8H2,1-2H3,(H2,16,17,18,19,20,21)
InChI Key:
XOPFESVZMSQIKC-UHFFFAOYSA-N
SMILES:
ClCCOc1ccccc1S(=O)(=O)NC(=O)Nc1nc(C)nc(n1)OC
UNII:
299LHF498M
Properties
Complexity:
560  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.056g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
401.822g/mol
Monoisotopic Mass:
401.056g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
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Properties