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ChemicalBook >> CAS DataBase List >>1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)-

1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)-

1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- Structure
1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- structure
CAS No.
2409178-86-3
Chemical Name:
1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)-
Synonyms
SARS 3CLpro-IN-1;1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)-
CBNumber:
CB212748536
Molecular Formula:
C22H38N4O2
Molecular Weight:
390.57
MDL Number:
MOL File:
2409178-86-3.mol
MSDS File:
SDS
Last updated:2025-04-18 09:51:49
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1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- Properties

Boiling point 556.9±40.0 °C(Predicted)
Density 1.056±0.06 g/cm3(Predicted)
pka 13.80±0.10(Predicted)

1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- Chemical Properties, Uses, Production

Uses

SARS 3CLpro-IN-1 (Compound 3b) is a SARS 3CL protease inhibitor with an IC50 value of 95 μM, as a specific stereo isomer of the octahydroisochromene scaffold, directs the P1 site imidazole[1].

References

[1] Shin-Ichiro Yoshizawa, et al. Evaluation of an octahydroisochromene scaffold used as a novel SARS 3CL protease inhibitor. Bioorg Med Chem. 2020 Feb 15;28(4):115273. DOI:10.1016/j.bmc.2019.115273

1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- Preparation Products And Raw materials

Raw materials

Preparation Products

1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- Suppliers

Global Suppliers ( 1)
Supplier Tel Email Country ProdList Advantage
TargetMol Chemicals Inc. 15002134094 marketing@targetmol.cn China 29874 58
Supplier Advantage
TargetMol Chemicals Inc. 58

2409178-86-3 (1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)-) Related Search:

1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- Brequinar Ritonavir SARS-CoV-2 3CLpro/3C-like protease protein SARS-COV-2 S protein RBD (194A.A, HEK293, HIS)
SARS-COV-2 S protein RBD (HEK293, FC)

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1H-Imidazole-5-propanal, α-[[[(1S,3S,4aR,8aS)-1-[(butylmethylamino)methyl]octahydro-1H-2-benzopyran-3-yl]methyl]amino]-, (αS)- SARS 3CLpro-IN-1 2409178-86-3