Home Sulfos 3-chloro-N-[2-chloro-5-(pyrrolidine-1-sulfonyl)phenyl]propanamide

3-chloro-N-[2-chloro-5-(pyrrolidine-1-sulfonyl)phenyl]propanamide

CAS No.:
1087784-08-4
Catalog Number:
AG019K78
Molecular Formula:
C13H16Cl2N2O3S
Molecular Weight:
351.2487
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Product Description
Catalog Number:
AG019K78
Chemical Name:
3-chloro-N-[2-chloro-5-(pyrrolidine-1-sulfonyl)phenyl]propanamide
CAS Number:
1087784-08-4
Molecular Formula:
C13H16Cl2N2O3S
Molecular Weight:
351.2487
MDL Number:
MFCD02215971
IUPAC Name:
3-chloro-N-(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)propanamide
InChI:
InChI=1S/C13H16Cl2N2O3S/c14-6-5-13(18)16-12-9-10(3-4-11(12)15)21(19,20)17-7-1-2-8-17/h3-4,9H,1-2,5-8H2,(H,16,18)
InChI Key:
VFMXOAWGDZGRPW-UHFFFAOYSA-N
SMILES:
ClCCC(=O)Nc1cc(ccc1Cl)S(=O)(=O)N1CCCC1
Properties
Complexity:
461  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.026g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
351.242g/mol
Monoisotopic Mass:
350.026g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties