2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide

2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide

Formula: C12H11Cl2N5OS

SMILES: NC1=CC(N)=NC(SCC(=O)NC2=C(Cl)C=CC=C2Cl)=N1

IUPAC: 2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]-N-(2,6-dichlorophenyl)acetamide

InChI: InChI=1S/C12H11Cl2N5OS/c13-6-2-1-3-7(14)11(6)19-10(20)5-21-12-17-8(15)4-9(16)18-12/h1-4H,5H2,(H,19,20)(H4,15,16,17,18)

Composition: C (41.87%), H (3.22%), Cl (20.60%), N (20.35%), O (4.65%), S (9.31%)

Molar Mass: 344.21

Atom Count: 32

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	343.0061366
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	AKDZIIHRFGRQGV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.57
Topological Polar Surface Area	106.92
Polarizability	32.24
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H11Cl2N5OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00