2-acetamido-1,3-thiazole-5-sulfonyl chloride

2-acetamido-1,3-thiazole-5-sulfonyl chloride

CAS: 69812-30-2

Formula: C5H5ClN2O3S2

SMILES: CC(=O)NC1=NC=C(S1)S(Cl)(=O)=O

IUPAC: 2-acetamido-1,3-thiazole-5-sulfonyl chloride

InChI: InChI=1S/C5H5ClN2O3S2/c1-3(9)8-5-7-2-4(12-5)13(6,10)11/h2H,1H3,(H,7,8,9)

Composition: C (24.95%), H (2.09%), Cl (14.73%), N (11.64%), O (19.94%), S (26.64%)

Molar Mass: 240.68

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	239.9430121
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	LYOHVKFYBJLEEP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.96
Topological Polar Surface Area	76.13
Polarizability	19.42
Ring Count	1
Rotatable Bond Count	2

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