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1-cyclohexyl-3-{[(furan-2-ylmethyl)carbamothioyl]amino}thiourea

1-cyclohexyl-3-{[(furan-2-ylmethyl)carbamothioyl]amino}thiourea

Formula: C13H20N4OS2

SMILES: S=C(NCC1=CC=CO1)NNC(=S)NC1CCCCC1

IUPAC: 1-cyclohexyl-3-({[(furan-2-yl)methyl]carbamothioyl}amino)thiourea

InChI: InChI=1S/C13H20N4OS2/c19-12(14-9-11-7-4-8-18-11)16-17-13(20)15-10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2,(H2,14,16,19)(H2,15,17,20)

Composition: C (49.97%), H (6.45%), N (17.93%), O (5.12%), S (20.52%)

Molar Mass: 312.45

Atom Count: 40

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 312.107853628
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 4
InChIKey IBHVMYOVGPKEJO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.48
Topological Polar Surface Area 61.26
Polarizability 34.46
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H20N4OS2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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