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

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

Formula: C23H26N6O3S

SMILES: COC1=CC=C(C)C=C1NC(=O)CSC1=NC(NC2=CC=CC=C2)=NC(=N1)N1CCOCC1

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

InChI: InChI=1S/C23H26N6O3S/c1-16-8-9-19(31-2)18(14-16)25-20(30)15-33-23-27-21(24-17-6-4-3-5-7-17)26-22(28-23)29-10-12-32-13-11-29/h3-9,14H,10-13,15H2,1-2H3,(H,25,30)(H,24,26,27,28)

Composition: C (59.21%), H (5.62%), N (18.01%), O (10.29%), S (6.87%)

Molar Mass: 466.56

Atom Count: 59

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	466.178709895
Formal Charge	0
FSP3	0.3
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
InChIKey	ROTJLQYVRNUNLG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	133.12
Topological Polar Surface Area	101.5
Polarizability	48.71
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C23H26N6O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00