2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one

2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one

CAS: 37123-09-4

Formula: C31H28N2O

SMILES: O=C1C2C(NC(C1C(NC2C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: 2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonan-9-one

InChI: InChI=1/C31H28N2O/c34-31-25-27(21-13-5-1-6-14-21)32-29(23-17-9-3-10-18-23)26(31)30(24-19-11-4-12-20-24)33-28(25)22-15-7-2-8-16-22/h1-20,25-30,32-33H

Composition: C (83.75%), H (6.35%), N (6.30%), O (3.60%)

Molar Mass: 444.578

Atom Count: 62

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	4
Exact Mass	444.22016353
Formal Charge	0
FSP3	0.19
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	ITTQAMYBEGYMAS-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	135.17
Topological Polar Surface Area	41.13
Polarizability	53.78
Ring Count	6
Rotatable Bond Count	4

Suppliers

Frinton Laboratories, Inc.

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<10 Days	37123-09-4		$58.50$58.50

Pale yellow crystalline powder