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397869-97-5 | N-(1,2,3,4-tetrahydroisoquinolin-5-yl)methanesulfonamide
CAS No: 397869-97-5 Catalog No: AG01A7GM MDL No:MFCD01861880
Product Description
Catalog Number:
AG01A7GM
Chemical Name:
N-(1,2,3,4-tetrahydroisoquinolin-5-yl)methanesulfonamide
CAS Number:
397869-97-5
Molecular Formula:
C10H14N2O2S
Molecular Weight:
226.2954
MDL Number:
MFCD01861880
IUPAC Name:
N-(1,2,3,4-tetrahydroisoquinolin-5-yl)methanesulfonamide
InChI:
InChI=1S/C10H14N2O2S/c1-15(13,14)12-10-4-2-3-8-7-11-6-5-9(8)10/h2-4,11-12H,5-7H2,1H3
InChI Key:
QBXFQTLJZAJJQN-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)Nc1cccc2c1CCNC2
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.078g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
226.294g/mol
Monoisotopic Mass:
226.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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