1-Piperazinecarbothioamide, N-(2-phenylethyl)-4-pyrazinyl-

HCID 3482010CAS 89007-42-1
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Basic information

Standard SMILES
S=C(NCCc1ccccc1)N1CCN(c2cnccn2)CC1
InChIKey
IWSWTFYSFLLNGV-UHFFFAOYSA-N
Molecular formula
C17H21N5S
Average molar mass
327.4 g/mol
Monoisotopic mass
327.15176686

Names & identifiers

Preferred name
1-Piperazinecarbothioamide, N-(2-phenylethyl)-4-pyrazinyl-
IUPAC
N-(2-phenylethyl)-4-pyrazin-2-ylpiperazine-1-carbothioamide

Names & synonyms

89007-42-11-Piperazinecarbothioamide, N-(2-phenylethyl)-4-pyrazinyl-Oprea1_455480SCHEMBL11077434DTXSID20392893IWSWTFYSFLLNGV-UHFFFAOYSA-NAB00042526-01N-Phenethyl-4-(2-pyrazinyl)-1-piperazinethiocarboxamideN-(2-PHENYLETHYL)-4-(PYRAZIN-2-YL)PIPERAZINE-1-CARBOTHIOAMIDE

Database identifiers

CAS
89007-42-1
PubChem CID
3482010
DTXSID
DTXSID20392893

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
76.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
23

Related reactions

2 records
New reaction record

Linked notes

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