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4-methyl-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide

4-methyl-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide structure

CAS No:
746605-33-4
Formula:
C14H18F3N3S
Chemical Name:
4-methyl-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide
Synonyms:
4-methyl-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide;ZINC2647263;AKOS034376339;MCULE-6866919178;Z45767549;746605-33-4

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4-methyl-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide Basic Attributes

Molecular Weight：

317.38 g/mol

Exact Mass：

317.11735325 g/mol

Characteristics

PSA：

50.6 Å²

Computed Properties

Molecular Weight:317.38
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:317.11735325
Monoisotopic Mass:317.11735325
Topological Polar Surface Area:50.6
Heavy Atom Count:21
Complexity:362
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-methyl-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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