2-({4,6-bis[(3,5-dimethylphenyl)amino]-1,3,5-triazin-2-yl}amino)propanoic acid

2-({4,6-bis[(3,5-dimethylphenyl)amino]-1,3,5-triazin-2-yl}amino)propanoic acid

Formula: C22H26N6O2

SMILES: CC(NC1=NC(NC2=CC(C)=CC(C)=C2)=NC(NC2=CC(C)=CC(C)=C2)=N1)C(O)=O

IUPAC: 2-({4,6-bis[(3,5-dimethylphenyl)amino]-1,3,5-triazin-2-yl}amino)propanoic acid

InChI: InChI=1/C22H26N6O2/c1-12-6-13(2)9-17(8-12)24-21-26-20(23-16(5)19(29)30)27-22(28-21)25-18-10-14(3)7-15(4)11-18/h6-11,16H,1-5H3,(H,29,30)(H3,23,24,25,26,27,28)

Composition: C (65.01%), H (6.45%), N (20.68%), O (7.87%)

Molar Mass: 406.49

Atom Count: 56

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	406.211724101
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
InChIKey	VZMCYZNFPRRNOP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.27
Topological Polar Surface Area	112.06
Polarizability	43.35
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H26N6O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00