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(1E)-1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-(2-methylphenyl)thiourea

(1E)-1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-(2-methylphenyl)thiourea structure

CAS No:
113367-94-5
Formula:
C16H16N6S
Chemical Name:
(1E)-1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-(2-methylphenyl)thiourea
Synonyms:
Urea,1-((2-benzimidazolyl)amidino)-2-thio-3-(o-tolyl); 1-((2-Benzimidazolyl)amidino)-2-thio-3-(o-tolyl)urea; Thiourea,N-((1H-benzimidazol-2-ylamino)iminomethyl)-N'-(2-methylphenyl);

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(1E)-1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-(2-methylphenyl)thiourea Basic Attributes

Molecular Weight：

324.40300

Exact Mass：

324.11571571

DSSTox ID：

DTXSID10150368

Characteristics

PSA：

116.26000

XLogP3：

3.89750

Density：

1.34g/cm3

Boiling Point：

525.2ºC

Flash Point：

271.4ºC

Refractive Index：

1.71

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:324.4
XLogP3:3.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:324.11571571
Monoisotopic Mass:324.11571571
Topological Polar Surface Area:109
Heavy Atom Count:23
Complexity:429
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (1E)-1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-(2-methylphenyl)thiourea

Basic Attributes
Characteristics
Computed Properties

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