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1803600-99-8

1803600-99-8 | 5-(piperazine-1-sulfonyl)-2,3-dihydro-1H-indol-2-one hydrochloride

CAS No: 1803600-99-8 Catalog No: AG019L77 MDL No:MFCD28145651

Product Description

Catalog Number:
AG019L77
Chemical Name:
5-(piperazine-1-sulfonyl)-2,3-dihydro-1H-indol-2-one hydrochloride
CAS Number:
1803600-99-8
Molecular Formula:
C12H16ClN3O3S
Molecular Weight:
317.7917
MDL Number:
MFCD28145651
IUPAC Name:
5-piperazin-1-ylsulfonyl-1,3-dihydroindol-2-one;hydrochloride
InChI:
InChI=1S/C12H15N3O3S.ClH/c16-12-8-9-7-10(1-2-11(9)14-12)19(17,18)15-5-3-13-4-6-15;/h1-2,7,13H,3-6,8H2,(H,14,16);1H
InChI Key:
BXZNYONYYDBQBD-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)cc(cc2)S(=O)(=O)N1CCNCC1.Cl

Properties

Complexity:
453  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.06g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
317.788g/mol
Monoisotopic Mass:
317.06g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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