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2-[(E)-[(4-fluorophenyl)methylidene]amino]-6-methyl-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

2-[(E)-[(4-fluorophenyl)methylidene]amino]-6-methyl-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Formula: C23H21FN2OS

SMILES: CC1CCC2=C(C1)SC(N=CC1=CC=C(F)C=C1)=C2C(=O)NC1=CC=CC=C1

IUPAC: 2-[(E)-[(4-fluorophenyl)methylidene]amino]-6-methyl-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1/C23H21FN2OS/c1-15-7-12-19-20(13-15)28-23(25-14-16-8-10-17(24)11-9-16)21(19)22(27)26-18-5-3-2-4-6-18/h2-6,8-11,14-15H,7,12-13H2,1H3,(H,26,27)/b25-14+

Composition: C (70.38%), H (5.39%), F (4.84%), N (7.14%), O (4.08%), S (8.17%)

Molar Mass: 392.49

Atom Count: 49

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 392.135862641
Formal Charge 0
FSP3 0.22
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey FLKYGQNRTDLNLT-AFUMVMLFNA-N
Lipinski's Rule of Five
Molar Refractivity 115.37
Topological Polar Surface Area 41.46
Polarizability 41.72
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 C23H21FN2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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