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1-(tert-butylamino)-3-[1-(1-methylimidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethoxy]propan-2-ol

1-(tert-butylamino)-3-[1-(1-methylimidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethoxy]propan-2-ol structure

CAS No:
121264-01-5
Formula:
C20H28F3N3O2
Chemical Name:
1-(tert-butylamino)-3-[1-(1-methylimidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethoxy]propan-2-ol
Synonyms:
2-Propanol,1-[(1,1-dimethylethyl)amino]-3-[1-(1-methyl-1H-imidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethoxy]; 1-(tert-butylamino)-3-{1-(1-methyl-1h-imidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethoxy}propan-2-ol; E 3753;

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1-(tert-butylamino)-3-[1-(1-methylimidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethoxy]propan-2-ol Basic Attributes

Molecular Weight：

399.45000

Exact Mass：

399.21336163 g/mol

Characteristics

PSA：

59.31000

XLogP3：

3.85890

Density：

1.16g/cm3

Boiling Point：

528ºC

Flash Point：

268.8ºC

Refractive Index：

1.509

Vapor Pressure：

1.13E-11mmHg at 25°C

Drug Information

MeSH Entry Terms：

E 3753

Computed Properties

Molecular Weight:399.4
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:399.21336163
Monoisotopic Mass:399.21336163
Topological Polar Surface Area:59.3
Heavy Atom Count:28
Complexity:498
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(tert-butylamino)-3-[1-(1-methylimidazol-2-yl)-1-[3-(trifluoromethyl)phenyl]ethoxy]propan-2-ol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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