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146387-13-5 | Benzenesulfonamide,N-[(1S,2R,3S,4R)-3-hydroxy-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl]-4-methyl-
CAS No: 146387-13-5 Catalog No: AG007J9D MDL No:MFCD08702650
Product Description
Catalog Number:
AG007J9D
Chemical Name:
Benzenesulfonamide,N-[(1S,2R,3S,4R)-3-hydroxy-4,7,7-trimethylbicyclo[2.2.1]hept-2-yl]-4-methyl-
CAS Number:
146387-13-5
Molecular Formula:
C17H25NO3S
Molecular Weight:
323.4503
MDL Number:
MFCD08702650
IUPAC Name:
N-(3-hydroxy-4,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C17H25NO3S/c1-11-5-7-12(8-6-11)22(20,21)18-14-13-9-10-17(4,15(14)19)16(13,2)3/h5-8,13-15,18-19H,9-10H2,1-4H3
InChI Key:
GFDDKFUXDVSRTB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)NC1C(O)C2(C(C1CC2)(C)C)C
Properties
Complexity:
531
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.156g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
323.451g/mol
Monoisotopic Mass:
323.156g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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