Home Sulfos 2-chloro-1-[6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]ethan-1-one

2-chloro-1-[6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]ethan-1-one

CAS No.:
949226-53-3
Catalog Number:
AG019PII
Molecular Formula:
C15H19ClN2O3S
Molecular Weight:
342.8410
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Product Description
Catalog Number:
AG019PII
Chemical Name:
2-chloro-1-[6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]ethan-1-one
CAS Number:
949226-53-3
Molecular Formula:
C15H19ClN2O3S
Molecular Weight:
342.8410
MDL Number:
MFCD09802015
IUPAC Name:
2-chloro-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone
InChI:
InChI=1S/C15H19ClN2O3S/c16-11-15(19)18-9-3-4-12-10-13(5-6-14(12)18)22(20,21)17-7-1-2-8-17/h5-6,10H,1-4,7-9,11H2
InChI Key:
BTCDUTBHRGKFJH-UHFFFAOYSA-N
SMILES:
ClCC(=O)N1CCCc2c1ccc(c2)S(=O)(=O)N1CCCC1
Properties
Complexity:
513  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.08g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.838g/mol
Monoisotopic Mass:
342.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties