 Home > Encyclopedia > (2S)-6-amino-N-(2-cyclohexylethyl)-2-[[(2S)-3-hydroxy-2-[[2-[4-[4-(2-methylimidazol-1-yl)butyl]phenyl]acetyl]amino]propanoyl]amino]hexanamide

(2S)-6-amino-N-(2-cyclohexylethyl)-2-[[(2S)-3-hydroxy-2-[[2-[4-[4-(2-methylimidazol-1-yl)butyl]phenyl]acetyl]amino]propanoyl]amino]hexanamide

(2S)-6-amino-N-(2-cyclohexylethyl)-2-[[(2S)-3-hydroxy-2-[[2-[4-[4-(2-methylimidazol-1-yl)butyl]phenyl]acetyl]amino]propanoyl]amino]hexanamide structure

CAS No:
164931-25-3
Formula:
C33H52N6O4
Chemical Name:
(2S)-6-amino-N-(2-cyclohexylethyl)-2-[[(2S)-3-hydroxy-2-[[2-[4-[4-(2-methylimidazol-1-yl)butyl]phenyl]acetyl]amino]propanoyl]amino]hexanamide
Synonyms:
MIM; [CYCLOHEXYLETHYL]-[[[[4-[2-METHYL-1-IMIDAZOLYL-BUTYL]PHENYL]ACETYL]-SERYL]-LYSINYL]-AMINE; L-Lysinamide,N-((4-(4-(2-methyl-1H-imidazol-1-yl)butyl)phenyl)acetyl)-L-seryl-N1-(2-cyclohexylethyl);

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(2S)-6-amino-N-(2-cyclohexylethyl)-2-[[(2S)-3-hydroxy-2-[[2-[4-[4-(2-methylimidazol-1-yl)butyl]phenyl]acetyl]amino]propanoyl]amino]hexanamide Basic Attributes

Molecular Weight：

596.80400

Exact Mass：

596.40500416 g/mol

DSSTox ID：

DTXSID00167824

Characteristics

PSA：

161.84000

XLogP3：

6.15560

Density：

1.21g/cm3

Boiling Point：

933.6ºC

Flash Point：

518.4ºC

Refractive Index：

1.6

Vapor Pressure：

0mmHg at 25°C

Drug Information

MeSH Entry Terms：

SC 58272

Computed Properties

Molecular Weight:596.8
XLogP3:3.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:19
Exact Mass:596.40500416
Monoisotopic Mass:596.40500416
Topological Polar Surface Area:151
Heavy Atom Count:43
Complexity:815
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (2S)-6-amino-N-(2-cyclohexylethyl)-2-[[(2S)-3-hydroxy-2-[[2-[4-[4-(2-methylimidazol-1-yl)butyl]phenyl]acetyl]amino]propanoyl]amino]hexanamide

Basic Attributes
Characteristics
Drug Information
Computed Properties

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