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pyrazin-2-ylthiourea

pyrazin-2-ylthiourea

CAS: 31437-05-5

Formula: C5H6N4S

SMILES: NC(=S)NC1=CN=CC=N1

IUPAC: (pyrazin-2-yl)thiourea

InChI: InChI=1S/C5H6N4S/c6-5(10)9-4-3-7-1-2-8-4/h1-3H,(H3,6,8,9,10)

Composition: C (38.95%), H (3.92%), N (36.34%), S (20.79%)

Molar Mass: 154.19

Atom Count: 16

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 154.031317383
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey TWGSSYKLXJRVDA-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.59
Topological Polar Surface Area 63.83
Polarizability 16.08
Ring Count 1
Rotatable Bond Count 1

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