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

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

Formula: C28H30FN7O

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

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

InChI: InChI=1/C28H30FN7O/c1-16-10-17(2)13-23(12-16)32-27-34-26(30-20(5)25(37)31-22-8-6-21(29)7-9-22)35-28(36-27)33-24-14-18(3)11-19(4)15-24/h6-15,20H,1-5H3,(H,31,37)(H3,30,32,33,34,35,36)

Composition: C (67.32%), H (6.05%), F (3.80%), N (19.63%), O (3.20%)

Molar Mass: 499.594

Atom Count: 67

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	1
Exact Mass	499.249586777
Formal Charge	0
FSP3	0.21
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
InChIKey	PQKULKYDICRQPN-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	148.76
Topological Polar Surface Area	103.86
Polarizability	53.27
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H30FN7O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00