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5-(4-tert-butylphenoxymethyl)-N-(pyridin-3-yl)furan-2-carboxamide

5-(4-tert-butylphenoxymethyl)-N-(pyridin-3-yl)furan-2-carboxamide

Formula: C21H22N2O3

SMILES: CC(C)(C)C1=CC=C(OCC2=CC=C(O2)C(=O)NC2=CN=CC=C2)C=C1

IUPAC: 5-[(4-tert-butylphenoxy)methyl]-N-(pyridin-3-yl)furan-2-carboxamide

InChI: InChI=1S/C21H22N2O3/c1-21(2,3)15-6-8-17(9-7-15)25-14-18-10-11-19(26-18)20(24)23-16-5-4-12-22-13-16/h4-13H,14H2,1-3H3,(H,23,24)

Composition: C (71.98%), H (6.33%), N (7.99%), O (13.70%)

Molar Mass: 350.418

Atom Count: 48

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 350.163042576
Formal Charge 0
FSP3 0.24
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey ADDHTLSQUNSMNN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 101.44
Topological Polar Surface Area 64.36
Polarizability 38.3
Ring Count 3
Rotatable Bond Count 6

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Purity LeadTime Formula UnitPrice
98% <10 Days C21H22N2O3 Quote Only