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1157923-52-8 | N-(1,2,3,4-tetrahydroisoquinolin-5-yl)ethane-1-sulfonamide
CAS No: 1157923-52-8 Catalog No: AG01AE7G MDL No:MFCD12067079
Product Description
Catalog Number:
AG01AE7G
Chemical Name:
N-(1,2,3,4-tetrahydroisoquinolin-5-yl)ethane-1-sulfonamide
CAS Number:
1157923-52-8
Molecular Formula:
C11H16N2O2S
Molecular Weight:
240.3219
MDL Number:
MFCD12067079
IUPAC Name:
N-(1,2,3,4-tetrahydroisoquinolin-5-yl)ethanesulfonamide
InChI:
InChI=1S/C11H16N2O2S/c1-2-16(14,15)13-11-5-3-4-9-8-12-7-6-10(9)11/h3-5,12-13H,2,6-8H2,1H3
InChI Key:
PFBQRNREMNZVCF-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)Nc1cccc2c1CCNC2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.093g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
240.321g/mol
Monoisotopic Mass:
240.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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