2-{[(2,4-dimethoxyphenyl)methyl]sulfanyl}pyridine-3-carboxylic acid

2-{[(2,4-dimethoxyphenyl)methyl]sulfanyl}pyridine-3-carboxylic acid

Formula: C15H15NO4S

SMILES: COC1=CC=C(CSC2=NC=CC=C2C(O)=O)C(OC)=C1

IUPAC: 2-{[(2,4-dimethoxyphenyl)methyl]sulfanyl}pyridine-3-carboxylic acid

InChI: InChI=1S/C15H15NO4S/c1-19-11-6-5-10(13(8-11)20-2)9-21-14-12(15(17)18)4-3-7-16-14/h3-8H,9H2,1-2H3,(H,17,18)

Composition: C (59.00%), H (4.95%), N (4.59%), O (20.96%), S (10.50%)

Molar Mass: 305.35

Atom Count: 36

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	305.072179141
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	GYPIIWGYDJKDHT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	81.82
Topological Polar Surface Area	68.65
Polarizability	31.31
Ring Count	2
Rotatable Bond Count	6

Suppliers

LabNetwork INC

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	1 Day	C15H15NO4S		$353.81-$1,238.33$353.81$619.16$1,238.33