3-{[1,1'-biphenyl]-4-yl}-4,5-bis(2-methylphenyl)-1,2,4-triazole

3-{[1,1'-biphenyl]-4-yl}-4,5-bis(2-methylphenyl)-1,2,4-triazole

Formula: C28H23N3

SMILES: CC1=CC=CC=C1N1C(=NN=C1C1=CC=CC=C1C)C1=CC=C(C=C1)C1=CC=CC=C1

IUPAC: 3-{[1,1'-biphenyl]-4-yl}-4,5-bis(2-methylphenyl)-4H-1,2,4-triazole

InChI: InChI=1S/C28H23N3/c1-20-10-6-8-14-25(20)28-30-29-27(31(28)26-15-9-7-11-21(26)2)24-18-16-23(17-19-24)22-12-4-3-5-13-22/h3-19H,1-2H3

Composition: C (83.76%), H (5.77%), N (10.47%)

Molar Mass: 401.513

Atom Count: 54

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	401.189197753
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	HZCQPAYZQLTBRI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	159.64
Topological Polar Surface Area	30.71
Polarizability	51.87
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H23N3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00