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5-tert-butyl-N-(4-tert-butylphenyl)-1-benzothiophen-3-amine

5-tert-butyl-N-(4-tert-butylphenyl)-1-benzothiophen-3-amine

Formula: C22H27NS

SMILES: CC(C)(C)C1=CC=C(NC2=CSC3=CC=C(C=C23)C(C)(C)C)C=C1

IUPAC: 5-tert-butyl-N-(4-tert-butylphenyl)-1-benzothiophen-3-amine

InChI: InChI=1S/C22H27NS/c1-21(2,3)15-7-10-17(11-8-15)23-19-14-24-20-12-9-16(13-18(19)20)22(4,5)6/h7-14,23H,1-6H3

Composition: C (78.29%), H (8.06%), N (4.15%), S (9.50%)

Molar Mass: 337.53

Atom Count: 51

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 337.186421047
Formal Charge 0
FSP3 0.36
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey IQIQXINXOBHSHZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 105.22
Topological Polar Surface Area 12.03
Polarizability 41.89
Ring Count 3
Rotatable Bond Count 4

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Purity LeadTime Formula UnitPrice
98% <10 Days C22H27NS Quote Only