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2-amino-N-(3-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

2-amino-N-(3-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Formula: C15H15ClN2OS

SMILES: NC1=C(C(=O)NC2=CC(Cl)=CC=C2)C2=C(CCCC2)S1

IUPAC: 2-amino-N-(3-chlorophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1S/C15H15ClN2OS/c16-9-4-3-5-10(8-9)18-15(19)13-11-6-1-2-7-12(11)20-14(13)17/h3-5,8H,1-2,6-7,17H2,(H,18,19)

Composition: C (58.72%), H (4.93%), Cl (11.55%), N (9.13%), O (5.21%), S (10.45%)

Molar Mass: 306.81

Atom Count: 35

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 306.059362
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey PDUWSCQCOXYEBD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 84.78
Topological Polar Surface Area 55.12
Polarizability 31.1
Ring Count 3
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H15ClN2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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