5-(4-chlorophenyl)-2-(methylsulfanyl)pyrimidin-4-amine

5-(4-chlorophenyl)-2-(methylsulfanyl)pyrimidin-4-amine

CAS: 1260910-16-4

Formula: C11H10ClN3S

SMILES: CSC1=NC(N)=C(C=N1)C1=CC=C(Cl)C=C1

IUPAC: 5-(4-chlorophenyl)-2-(methylsulfanyl)pyrimidin-4-amine

InChI: InChI=1S/C11H10ClN3S/c1-16-11-14-6-9(10(13)15-11)7-2-4-8(12)5-3-7/h2-6H,1H3,(H2,13,14,15)

Composition: C (52.48%), H (4.00%), Cl (14.08%), N (16.69%), S (12.74%)

Molar Mass: 251.73

Atom Count: 26

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	251.0283962
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ABZSRJDBGVBOKD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.38
Topological Polar Surface Area	51.8
Polarizability	27.4
Ring Count	2
Rotatable Bond Count	2

Suppliers

Key Organics Ltd

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	1260910-16-4		$51.35-$1,580.85$51.35$63.37$86.31$235.98$1,119.81$1,580.85