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4-{4-[4'-(pyridin-4-yl)-2,3,5,6-tetrakis[4-(pyridin-4-yl)phenyl]-[1,1'-biphenyl]-4-yl]phenyl}pyridine

4-{4-[4'-(pyridin-4-yl)-2,3,5,6-tetrakis[4-(pyridin-4-yl)phenyl]-[1,1'-biphenyl]-4-yl]phenyl}pyridine

CAS: 591215-23-5

Formula: C72H48N6

SMILES: C1=CC(=CC=N1)C1=CC=C(C=C1)C1=C(C2=CC=C(C=C2)C2=CC=NC=C2)C(C2=CC=C(C=C2)C2=CC=NC=C2)=C(C2=CC=C(C=C2)C2=CC=NC=C2)C(C2=CC=C(C=C2)C2=CC=NC=C2)=C1C1=CC=C(C=C1)C1=CC=NC=C1

IUPAC: 4-{4-[4'-(pyridin-4-yl)-2,3,5,6-tetrakis[4-(pyridin-4-yl)phenyl]-[1,1'-biphenyl]-4-yl]phenyl}pyridine

InChI: InChI=1S/C72H48N6/c1-13-61(14-2-49(1)55-25-37-73-38-26-55)67-68(62-15-3-50(4-16-62)56-27-39-74-40-28-56)70(64-19-7-52(8-20-64)58-31-43-76-44-32-58)72(66-23-11-54(12-24-66)60-35-47-78-48-36-60)71(65-21-9-53(10-22-65)59-33-45-77-46-34-59)69(67)63-17-5-51(6-

Composition: C (86.72%), H (4.85%), N (8.43%)

Molar Mass: 997.218

Atom Count: 126

Heavy Atom Count: 78

Properties
Properties
Common Names N/A
Aromatic Ring Count 13
Asymmetric Atom Count 0
Exact Mass 996.39404557
Formal Charge 0
FSP3 0
Hetero Ring Count 6
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey KQMAXWHSCXCCAN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 314.75
Topological Polar Surface Area 77.34
Polarizability 138.12
Ring Count 13
Rotatable Bond Count 12

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98% <5 Days 591215-23-5 $74.40$74.40
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