3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-methylphenyl)propanamide

3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-methylphenyl)propanamide

Formula: C16H19N3OS

SMILES: CC1=CC=C(NC(=O)CCSC2=NC(C)=CC(C)=N2)C=C1

IUPAC: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-(4-methylphenyl)propanamide

InChI: InChI=1S/C16H19N3OS/c1-11-4-6-14(7-5-11)19-15(20)8-9-21-16-17-12(2)10-13(3)18-16/h4-7,10H,8-9H2,1-3H3,(H,19,20)

Composition: C (63.76%), H (6.35%), N (13.94%), O (5.31%), S (10.64%)

Molar Mass: 301.41

Atom Count: 40

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	301.124883418
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	HOMBPURWMPTTKJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.76
Topological Polar Surface Area	54.88
Polarizability	33.22
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H19N3OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00