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N-methyl-4-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide

N-methyl-4-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide structure

CAS No:
77051-86-6
Formula:
C20H22N4O3S
Chemical Name:
N-methyl-4-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide

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N-methyl-4-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide Basic Attributes

Molecular Weight：

398.47900

Exact Mass：

398.14126175

Characteristics

PSA：

129.32000

XLogP3：

4.70910

Density：

1.33g/cm3

Boiling Point：

594.6ºC at 760 mmHg

Flash Point：

313.4ºC

Refractive Index：

1.665

Computed Properties

Molecular Weight:398.5
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:398.14126175
Monoisotopic Mass:398.14126175
Topological Polar Surface Area:122
Heavy Atom Count:28
Complexity:568
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-methyl-4-nitro-N-[2-(phenylcarbamothioylamino)cyclopentyl]benzamide

Basic Attributes
Characteristics
Computed Properties

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