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866041-15-8 | 4-iodo-N-(1-methylpiperidin-4-yl)benzene-1-sulfonamide
CAS No: 866041-15-8 Catalog No: AG00IR2C MDL No:MFCD04125740
Product Description
Catalog Number:
AG00IR2C
Chemical Name:
4-iodo-N-(1-methylpiperidin-4-yl)benzene-1-sulfonamide
CAS Number:
866041-15-8
Molecular Formula:
C12H17IN2O2S
Molecular Weight:
380.2450
MDL Number:
MFCD04125740
IUPAC Name:
4-iodo-N-(1-methylpiperidin-4-yl)benzenesulfonamide
InChI:
InChI=1S/C12H17IN2O2S/c1-15-8-6-11(7-9-15)14-18(16,17)12-4-2-10(13)3-5-12/h2-5,11,14H,6-9H2,1H3
InChI Key:
PYPFDMIBBHUOEE-UHFFFAOYSA-N
SMILES:
CN1CCC(CC1)NS(=O)(=O)c1ccc(cc1)I
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.006g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
380.244g/mol
Monoisotopic Mass:
380.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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