1H-Benzimidazole-2-carboxamide,N-[(1R)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-3-cyclopropyl-2,3-dihydroxypropyl]amino]-2-oxo-1-(4-thiazolylmethyl)ethyl]-


Chemical Name: 1H-Benzimidazole-2-carboxamide,N-[(1R)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-3-cyclopropyl-2,3-dihydroxypropyl]amino]-2-oxo-1-(4-thiazolylmethyl)ethyl]-
CAS Number: 134362-79-1
Product Number: AG0070PJ(AGN-PC-0PKA3C)
Synonyms:
MDL No:
Molecular Formula: C27H35N5O4S
Molecular Weight: 525.6629

Identification/Properties


Computed Properties
Molecular Weight:
525.668g/mol
XLogP3:
4.2
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
11
Exact Mass:
525.241g/mol
Monoisotopic Mass:
525.241g/mol
Topological Polar Surface Area:
169A^2
Heavy Atom Count:
37
Formal Charge:
0
Complexity:
780
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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Chemical Structure



The compound N-[(1R)-2-[[(1S,2R,3S)-1-(cyclohexylmethyl)-3-cyclopropyl-2,3-dihydroxypropyl]amino]-2-oxo-1-(thiazol-4-ylmethyl)ethyl]-1H-benzo[d]imidazole-2-carboxamide is commonly utilized in chemical synthesis as a versatile building block. Its unique structure containing amino, oxo, thiazol, and benzoimidazole moieties provides opportunities for synthetic chemists to introduce various functional groups through strategic modifications. In organic synthesis, this compound can serve as a key intermediate for the preparation of diverse organic molecules with specific biological activities or desired properties. Its incorporation in the synthetic route enables the construction of complex molecular structures and the development of novel compounds for potential applications in pharmaceuticals, agrochemicals, materials science, and other research areas.