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N-(3,4-dichlorophenyl)-5-{2-[1-(furan-2-yl)ethyl]diazen-1-yl}-1,3,4-thiadiazol-2-amine

N-(3,4-dichlorophenyl)-5-{2-[1-(furan-2-yl)ethyl]diazen-1-yl}-1,3,4-thiadiazol-2-amine

CAS: 866152-05-8

Formula: C14H11Cl2N5OS

SMILES: CC(N=NC1=NN=C(NC2=CC(Cl)=C(Cl)C=C2)S1)C1=CC=CO1

IUPAC: N-(3,4-dichlorophenyl)-5-{2-[1-(furan-2-yl)ethyl]diazen-1-yl}-1,3,4-thiadiazol-2-amine

InChI: InChI=1/C14H11Cl2N5OS/c1-8(12-3-2-6-22-12)18-20-14-21-19-13(23-14)17-9-4-5-10(15)11(16)7-9/h2-8H,1H3,(H,17,19)

Composition: C (45.66%), H (3.01%), Cl (19.25%), N (19.02%), O (4.34%), S (8.71%)

Molar Mass: 368.24

Atom Count: 34

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 367.0061366
Formal Charge 0
FSP3 0.14
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey CQPIPZOAUWWXQA-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity 92.38
Topological Polar Surface Area 75.67
Polarizability 33.73
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 866152-05-8 $51.35-$86.31$51.35$63.37$86.31
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