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3-methyl-N-[(pyridine-4-carbonylamino)carbamothioyl]butanamide

3-methyl-N-[(pyridine-4-carbonylamino)carbamothioyl]butanamide structure

CAS No:
108482-60-6
Formula:
C12H16N4O2S
Chemical Name:
3-methyl-N-[(pyridine-4-carbonylamino)carbamothioyl]butanamide
Synonyms:
1-isonicotinoyl-4-isovaleryl thiosemicarbazide;ZINC1864203;AKOS003215785;108482-60-6

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3-methyl-N-[(pyridine-4-carbonylamino)carbamothioyl]butanamide Basic Attributes

Molecular Weight：

280.35 g/mol

Exact Mass：

280.09939694 g/mol

Characteristics

PSA：

115 Å²

XLogP3：

1.9359

Melting Point：

162 - 163 °C (acetonitrile)

Computed Properties

Molecular Weight:280.35
XLogP3:1.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:280.09939694
Monoisotopic Mass:280.09939694
Topological Polar Surface Area:115
Heavy Atom Count:19
Complexity:341
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-methyl-N-[(pyridine-4-carbonylamino)carbamothioyl]butanamide

Basic Attributes
Characteristics
Computed Properties

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