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N-(4-acetylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

N-(4-acetylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

CAS: 7062-14-8

Formula: C17H17NO2S

SMILES: CC(=O)C1=CC=C(NC(=O)C2=CSC3=C2CCCC3)C=C1

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

InChI: InChI=1S/C17H17NO2S/c1-11(19)12-6-8-13(9-7-12)18-17(20)15-10-21-16-5-3-2-4-14(15)16/h6-10H,2-5H2,1H3,(H,18,20)

Composition: C (68.20%), H (5.72%), N (4.68%), O (10.69%), S (10.71%)

Molar Mass: 299.39

Atom Count: 38

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 299.097999965
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QCHRPIDSGGOKEJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.52
Topological Polar Surface Area 46.17
Polarizability 31.81
Ring Count 3
Rotatable Bond Count 3

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95% <2 Days 7062-14-8 $134.76$134.76
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