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N-[(1Z)-1-(1-hydroxypyridin-2-ylidene)ethyl]imino-4-phenylpiperazine-1-carbothioamide

N-[(1Z)-1-(1-hydroxypyridin-2-ylidene)ethyl]imino-4-phenylpiperazine-1-carbothioamide structure

CAS No:
87587-12-0
Formula:
C18H21N5OS
Chemical Name:
N-[(1Z)-1-(1-hydroxypyridin-2-ylidene)ethyl]imino-4-phenylpiperazine-1-carbothioamide

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N-[(1Z)-1-(1-hydroxypyridin-2-ylidene)ethyl]imino-4-phenylpiperazine-1-carbothioamide Basic Attributes

Molecular Weight：

355.45700

Exact Mass：

355.14668148

NSC Number：

351083

DSSTox ID：

DTXSID60658622

Characteristics

PSA：

88.42000

XLogP3：

2.92960

Density：

1.25g/cm3

Boiling Point：

504.2ºC

Flash Point：

258.8ºC

Refractive Index：

1.652

Computed Properties

Molecular Weight:355.5
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:355.14668148
Monoisotopic Mass:355.14668148
Topological Polar Surface Area:86.8
Heavy Atom Count:25
Complexity:599
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[(1Z)-1-(1-hydroxypyridin-2-ylidene)ethyl]imino-4-phenylpiperazine-1-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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