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

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

Formula: C25H24ClN7O

SMILES: CC(NC1=NC(NC2=CC=CC=C2)=NC(NC2=CC=CC=C2)=N1)C(=O)NC1=CC=C(C)C(Cl)=C1

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

InChI: InChI=1/C25H24ClN7O/c1-16-13-14-20(15-21(16)26)28-22(34)17(2)27-23-31-24(29-18-9-5-3-6-10-18)33-25(32-23)30-19-11-7-4-8-12-19/h3-15,17H,1-2H3,(H,28,34)(H3,27,29,30,31,32,33)

Composition: C (63.35%), H (5.10%), Cl (7.48%), N (20.69%), O (3.38%)

Molar Mass: 473.97

Atom Count: 58

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	1
Exact Mass	473.1730861
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
InChIKey	MLACMWXBXAKGLV-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	138.23
Topological Polar Surface Area	103.86
Polarizability	50.19
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H24ClN7O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00