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3-[(4-chloroanilino)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione

3-[(4-chloroanilino)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione structure

CAS No:
84249-81-0
Formula:
C14H11ClN4OS
Chemical Name:
3-[(4-chloroanilino)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione

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3-[(4-chloroanilino)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione Basic Attributes

Molecular Weight：

318.78100

Exact Mass：

318.0342099

DSSTox ID：

DTXSID90233168

Characteristics

PSA：

87.97000

XLogP3：

4.06360

Density：

1.43g/cm3

Boiling Point：

493.4ºC at 760 mmHg

Flash Point：

252.2ºC

Refractive Index：

1.7

Computed Properties

Molecular Weight:318.8
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:318.0342099
Monoisotopic Mass:318.0342099
Topological Polar Surface Area:81.8
Heavy Atom Count:21
Complexity:406
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[(4-chloroanilino)methyl]-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione

Basic Attributes
Characteristics
Computed Properties

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