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N-(4-chlorophenyl)-4-(diphenylmethyl)piperazine-1-carbothioamide

N-(4-chlorophenyl)-4-(diphenylmethyl)piperazine-1-carbothioamide

Formula: C24H24ClN3S

SMILES: ClC1=CC=C(NC(=S)N2CCN(CC2)C(C2=CC=CC=C2)C2=CC=CC=C2)C=C1

IUPAC: N-(4-chlorophenyl)-4-(diphenylmethyl)piperazine-1-carbothioamide

InChI: InChI=1S/C24H24ClN3S/c25-21-11-13-22(14-12-21)26-24(29)28-17-15-27(16-18-28)23(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-14,23H,15-18H2,(H,26,29)

Composition: C (68.31%), H (5.73%), Cl (8.40%), N (9.96%), S (7.60%)

Molar Mass: 421.99

Atom Count: 53

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 421.1379467
Formal Charge 0
FSP3 0.21
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey NTKIHMFUMSIHNW-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 127.13
Topological Polar Surface Area 18.51
Polarizability 48.97
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C24H24ClN3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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