2-bromo-N-methyl-1,3-thiazole-4-carboxamide

2-bromo-N-methyl-1,3-thiazole-4-carboxamide

CAS: 1092942-42-1

Formula: C5H5BrN2OS

SMILES: CNC(=O)C1=CSC(Br)=N1

IUPAC: 2-bromo-N-methyl-1,3-thiazole-4-carboxamide

InChI: InChI=1S/C5H5BrN2OS/c1-7-4(9)3-2-10-5(6)8-3/h2H,1H3,(H,7,9)

Composition: C (27.17%), H (2.28%), Br (36.14%), N (12.67%), O (7.24%), S (14.50%)

Molar Mass: 221.07

Atom Count: 15

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	219.930597
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	IIVIJFKYLPGNBP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.49
Topological Polar Surface Area	41.99
Polarizability	16.05
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	1092942-42-1		$63.05-$158.89$63.05$158.89