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N-(2-chloro-5-nitrophenyl)pyrrolidine-1-carbothioamide

N-(2-chloro-5-nitrophenyl)pyrrolidine-1-carbothioamide structure

CAS No:
794582-90-4
Formula:
C11H12ClN3O2S
Chemical Name:
N-(2-chloro-5-nitrophenyl)pyrrolidine-1-carbothioamide
Synonyms:
MLS001171213;CHEMBL1581665;N-(2-chloro-5-nitrophenyl)pyrrolidine-1-carbothioamide;HMS2891K16;ZINC3327547;AKOS008944151;MCULE-1205313956;SMR000590730;Z45794815;794582-90-4

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N-(2-chloro-5-nitrophenyl)pyrrolidine-1-carbothioamide Basic Attributes

Molecular Weight：

285.75 g/mol

Exact Mass：

285.0338755 g/mol

Characteristics

PSA：

93.2 Å²

Water Solubility：

9.7 [ug/mL]

Computed Properties

Molecular Weight:285.75
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:285.0338755
Monoisotopic Mass:285.0338755
Topological Polar Surface Area:93.2
Heavy Atom Count:18
Complexity:331
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(2-chloro-5-nitrophenyl)pyrrolidine-1-carbothioamide

Basic Attributes
Characteristics
Computed Properties

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