200,000+ products from a single source!
sales@angenechem.com
156186-57-1 | 1H-Pyrazole-4-carboxylic acid, 3-chloro-5-[[(ethoxycarbonyl)amino]sulfonyl]-1-methyl-, ethyl ester
CAS No: 156186-57-1 Catalog No: AG001OK8 MDL No:
Product Description
Catalog Number:
AG001OK8
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 3-chloro-5-[[(ethoxycarbonyl)amino]sulfonyl]-1-methyl-, ethyl ester
CAS Number:
156186-57-1
Molecular Formula:
C10H14ClN3O6S
Molecular Weight:
339.7527
IUPAC Name:
ethyl 3-chloro-5-(ethoxycarbonylsulfamoyl)-1-methylpyrazole-4-carboxylate
InChI:
InChI=1S/C10H14ClN3O6S/c1-4-19-9(15)6-7(11)12-14(3)8(6)21(17,18)13-10(16)20-5-2/h4-5H2,1-3H3,(H,13,16)
InChI Key:
JYINQKAMADSUTB-UHFFFAOYSA-N
SMILES:
CCOC(=O)NS(=O)(=O)c1n(C)nc(c1C(=O)OCC)Cl
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.029g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
339.747g/mol
Monoisotopic Mass:
339.029g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.