2-{[(3-methoxyphenyl)methyl]sulfanyl}pyrimidine-4,6-diamine

2-{[(3-methoxyphenyl)methyl]sulfanyl}pyrimidine-4,6-diamine

Formula: C12H14N4OS

SMILES: COC1=CC=CC(CSC2=NC(N)=CC(N)=N2)=C1

IUPAC: 2-{[(3-methoxyphenyl)methyl]sulfanyl}pyrimidine-4,6-diamine

InChI: InChI=1S/C12H14N4OS/c1-17-9-4-2-3-8(5-9)7-18-12-15-10(13)6-11(14)16-12/h2-6H,7H2,1H3,(H4,13,14,15,16)

Composition: C (54.94%), H (5.38%), N (21.36%), O (6.10%), S (12.22%)

Molar Mass: 262.33

Atom Count: 32

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	262.088832261
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	NSRFTCMSGJLFQI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.58
Topological Polar Surface Area	87.05
Polarizability	27.84
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H14N4OS		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00