5-(3-chlorophenyl)-2-(piperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine-7-carboxylic acid

5-(3-chlorophenyl)-2-(piperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine-7-carboxylic acid

Formula: C18H16ClN3O2S

SMILES: OC(=O)C1=C2SC(=NC2=NC(=C1)C1=CC(Cl)=CC=C1)N1CCCCC1

IUPAC: 5-(3-chlorophenyl)-2-(piperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine-7-carboxylic acid

InChI: InChI=1S/C18H16ClN3O2S/c19-12-6-4-5-11(9-12)14-10-13(17(23)24)15-16(20-14)21-18(25-15)22-7-2-1-3-8-22/h4-6,9-10H,1-3,7-8H2,(H,23,24)

Composition: C (57.83%), H (4.31%), Cl (9.48%), N (11.24%), O (8.56%), S (8.58%)

Molar Mass: 373.86

Atom Count: 41

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	373.0651756
Formal Charge	0
FSP3	0.28
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	NQUARGOVHABFHH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	99.41
Topological Polar Surface Area	66.32
Polarizability	38.83
Ring Count	4
Rotatable Bond Count	3

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C18H16ClN3O2S		Quote Only