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89725-18-8

89725-18-8 | 1H-Benzimidazole-5-sulfonamide, 6-chloro-2-pentyl-

CAS No: 89725-18-8 Catalog No: AG004200 MDL No:

Product Description

Catalog Number:
AG004200
Chemical Name:
1H-Benzimidazole-5-sulfonamide, 6-chloro-2-pentyl-
CAS Number:
89725-18-8
Molecular Formula:
C12H16ClN3O2S
Molecular Weight:
301.7923
IUPAC Name:
6-chloro-2-pentyl-3H-benzimidazole-5-sulfonamide
InChI:
InChI=1S/C12H16ClN3O2S/c1-2-3-4-5-12-15-9-6-8(13)11(19(14,17)18)7-10(9)16-12/h6-7H,2-5H2,1H3,(H,15,16)(H2,14,17,18)
InChI Key:
LJZVGANTTPQISJ-UHFFFAOYSA-N
SMILES:
CCCCCc1[nH]c2c(n1)cc(c(c2)Cl)S(=O)(=O)N

Properties

Complexity:
398  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.065g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
301.789g/mol
Monoisotopic Mass:
301.065g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
97.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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