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Ml264

CAS No.:
1550008-55-3
Catalog Number:
AG001NJ8
Molecular Formula:
C17H21ClN2O4S
Molecular Weight:
384.8776
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$91
- +
5mg
≥98%
1 week
United States
$169
- +
10mg
≥98%
1 week
United States
$248
- +
25mg
≥98%
1 week
United States
$404
- +
50mg
99%
1 week
United States
$668
- +
100mg
99%
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG001NJ8
Chemical Name:
Ml264
CAS Number:
1550008-55-3
Molecular Formula:
C17H21ClN2O4S
Molecular Weight:
384.8776
MDL Number:
MFCD30187519
IUPAC Name:
(E)-3-(3-chlorophenyl)-N-[2-[(1,1-dioxothian-4-yl)-methylamino]-2-oxoethyl]prop-2-enamide
InChI:
InChI=1S/C17H21ClN2O4S/c1-20(15-7-9-25(23,24)10-8-15)17(22)12-19-16(21)6-5-13-3-2-4-14(18)11-13/h2-6,11,15H,7-10,12H2,1H3,(H,19,21)/b6-5+
InChI Key:
AJCDZIDKYKCOMZ-AATRIKPKSA-N
SMILES:
O=C(NCC(=O)N(C1CCS(=O)(=O)CC1)C)/C=C/c1cccc(c1)Cl
Properties
Complexity:
601  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
384.091g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
384.875g/mol
Monoisotopic Mass:
384.091g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties