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ChemicalBook >> CAS DataBase List >>1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]-

1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]-

1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]- Structure
1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]- structure
CAS No.
2253951-38-9
Chemical Name:
1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]-
Synonyms
LpxC-IN-5;1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]-
CBNumber:
CB98379963
Molecular Formula:
C21H24N4O5
Molecular Weight:
412.44
MDL Number:
MOL File:
2253951-38-9.mol
Last updated:2025-04-18 09:53:10
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1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]- Properties

Boiling point 761.3±60.0 °C(Predicted)
Density 1.32±0.1 g/cm3(Predicted)
pka 11.83±0.20(Predicted)

1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]- Chemical Properties,Uses,Production

Uses

LpxC-IN-5 is a potent non-hydroxamate LpxC (UDP-3-O-acyl-N-acetylglucosamine deacetylase) inhibitor with an IC50 of 20 nM. LpxC-IN-5 shows antibacterial activity against E. coli ATCC25922, P. aeruginosa ATCC27853, K. pneumoniae ATCC13883 and P. aeruginosa 5567 with MIC of 16, 4, 64, and 4 μg/mL, respectively[1].

References

[1] Yamada Y, et al. Fragment-Based Discovery of Novel Non-Hydroxamate LpxC Inhibitors with Antibacterial Activity [published online ahead of print, 2020 Nov 19]. J Med Chem. 2020;10.1021/acs.jmedchem.0c01215. DOI:10.1021/acs.jmedchem.0c01215

1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]- Preparation Products And Raw materials

Raw materials

Preparation Products

1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]- Suppliers

Global( 4)Suppliers
Supplier Tel Email Country ProdList Advantage
ShangHai Caerulum Pharma Discovery Co., Ltd. 18149758185 sales-cpd@caerulumpharma.com China 3506 58
Suzhou youruike Chemical Pharmaceutical Technology Co., Ltd 15317229551 15151849396@163.com China 987 58
Shaanxi DIDU pharmaceutical and Chemical Co., Ltd 029-029-81120477 17792793610 1033@dideu.com China 9898 58
TargetMol Chemicals Inc. 4008200310 marketing@tsbiochem.com China 24961 58
Supplier Advantage
ShangHai Caerulum Pharma Discovery Co., Ltd. 58
Suzhou youruike Chemical Pharmaceutical Technology Co., Ltd 58
Shaanxi DIDU pharmaceutical and Chemical Co., Ltd 58
TargetMol Chemicals Inc. 58
1,3-Propanediol, 2-amino-2-[[4-[2-[3-[[2-[(1S)-1-hydroxyethyl]-1H-imidazol-1-yl]methyl]-5-isoxazolyl]ethynyl]phenoxy]methyl]- LpxC-IN-5 2253951-38-9