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N-(4-ethoxyphenyl)-4-phenyl-2-(2-phenylacetamido)thiophene-3-carboxamide

N-(4-ethoxyphenyl)-4-phenyl-2-(2-phenylacetamido)thiophene-3-carboxamide

Formula: C27H24N2O3S

SMILES: CCOC1=CC=C(NC(=O)C2=C(NC(=O)CC3=CC=CC=C3)SC=C2C2=CC=CC=C2)C=C1

IUPAC: N-(4-ethoxyphenyl)-4-phenyl-2-(2-phenylacetamido)thiophene-3-carboxamide

InChI: InChI=1S/C27H24N2O3S/c1-2-32-22-15-13-21(14-16-22)28-26(31)25-23(20-11-7-4-8-12-20)18-33-27(25)29-24(30)17-19-9-5-3-6-10-19/h3-16,18H,2,17H2,1H3,(H,28,31)(H,29,30)

Composition: C (71.03%), H (5.30%), N (6.14%), O (10.51%), S (7.02%)

Molar Mass: 456.56

Atom Count: 57

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 456.150763815
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey HHPJQABBBBSHNE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 133.79
Topological Polar Surface Area 67.43
Polarizability 51.4
Ring Count 4
Rotatable Bond Count 8

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C27H24N2O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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