2-{[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]sulfanyl}-N-(4-acetamidophenyl)acetamide

2-{[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]sulfanyl}-N-(4-acetamidophenyl)acetamide

Formula: C25H23N7O2S

SMILES: CC(=O)NC1=CC=C(NC(=O)CSC2=NC(NC3=CC=CC=C3)=NC(NC3=CC=CC=C3)=N2)C=C1

IUPAC: 2-{[4,6-bis(phenylamino)-1,3,5-triazin-2-yl]sulfanyl}-N-(4-acetamidophenyl)acetamide

InChI: InChI=1S/C25H23N7O2S/c1-17(33)26-20-12-14-21(15-13-20)27-22(34)16-35-25-31-23(28-18-8-4-2-5-9-18)30-24(32-25)29-19-10-6-3-7-11-19/h2-15H,16H2,1H3,(H,26,33)(H,27,34)(H2,28,29,30,31,32)

Composition: C (61.84%), H (4.77%), N (20.19%), O (6.59%), S (6.60%)

Molar Mass: 485.57

Atom Count: 58

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	485.163394183
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
InChIKey	OGXCBHGILLMOMU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	141.46
Topological Polar Surface Area	120.93
Polarizability	51.55
Ring Count	4
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H23N7O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00