2-{[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]amino}-N-(2,6-dimethylphenyl)propanamide

2-{[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]amino}-N-(2,6-dimethylphenyl)propanamide

Formula: C26H27N7O

SMILES: CC(NC1=NC(NC2=CC=CC=C2)=NC(NC2=CC=CC=C2)=N1)C(=O)NC1=C(C)C=CC=C1C

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

InChI: InChI=1/C26H27N7O/c1-17-11-10-12-18(2)22(17)30-23(34)19(3)27-24-31-25(28-20-13-6-4-7-14-20)33-26(32-24)29-21-15-8-5-9-16-21/h4-16,19H,1-3H3,(H,30,34)(H3,27,28,29,31,32,33)

Composition: C (68.85%), H (6.00%), N (21.62%), O (3.53%)

Molar Mass: 453.55

Atom Count: 61

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	1
Exact Mass	453.227708517
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
InChIKey	XREQUXKFJDCADW-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	138.46
Topological Polar Surface Area	103.86
Polarizability	50.09
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H27N7O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00