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N-[(3,5-difluorophenyl)methyl]-2'-{[2-(4-methoxyphenyl)acetamido]methyl}-[1,1'-biphenyl]-2-carboxamide

N-[(3,5-difluorophenyl)methyl]-2'-{[2-(4-methoxyphenyl)acetamido]methyl}-[1,1'-biphenyl]-2-carboxamide

CAS: 1795300-41-2

Formula: C30H26F2N2O3

SMILES: COC1=CC=C(CC(=O)NCC2=C(C=CC=C2)C2=C(C=CC=C2)C(=O)NCC2=CC(F)=CC(F)=C2)C=C1

IUPAC: N-[(3,5-difluorophenyl)methyl]-2'-{[2-(4-methoxyphenyl)acetamido]methyl}-[1,1'-biphenyl]-2-carboxamide

InChI: InChI=1S/C30H26F2N2O3/c1-37-25-12-10-20(11-13-25)16-29(35)33-19-22-6-2-3-7-26(22)27-8-4-5-9-28(27)30(36)34-18-21-14-23(31)17-24(32)15-21/h2-15,17H,16,18-19H2,1H3,(H,33,35)(H,34,36)

Composition: C (71.99%), H (5.24%), F (7.59%), N (5.60%), O (9.59%)

Molar Mass: 500.546

Atom Count: 63

Heavy Atom Count: 37

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 500.191149031
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey SZBXLBPLXXPKTL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 139.32
Topological Polar Surface Area 67.43
Polarizability 53.67
Ring Count 4
Rotatable Bond Count 9

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