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126826-54-8 | Benzenesulfonamide, N-(1-ethyl-2-pyrrolidinylidene)-4-(methylamino)-
CAS No: 126826-54-8 Catalog No: AG000TAN MDL No:
Product Description
Catalog Number:
AG000TAN
Chemical Name:
Benzenesulfonamide, N-(1-ethyl-2-pyrrolidinylidene)-4-(methylamino)-
CAS Number:
126826-54-8
Molecular Formula:
C13H19N3O2S
Molecular Weight:
281.3739
IUPAC Name:
N-(1-ethylpyrrolidin-2-ylidene)-4-(methylamino)benzenesulfonamide
InChI:
InChI=1S/C13H19N3O2S/c1-3-16-10-4-5-13(16)15-19(17,18)12-8-6-11(14-2)7-9-12/h6-9,14H,3-5,10H2,1-2H3
InChI Key:
JHWWZDZNJCDLQD-UHFFFAOYSA-N
SMILES:
CCN1CCCC1=NS(=O)(=O)c1ccc(cc1)NC
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.12g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.374g/mol
Monoisotopic Mass:
281.12g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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