N-(5-bromopyrimidin-2-yl)methanesulfonamide

N-(5-bromopyrimidin-2-yl)methanesulfonamide

CAS: 1242336-55-5

Formula: C5H6BrN3O2S

SMILES: CS(=O)(=O)NC1=NC=C(Br)C=N1

IUPAC: N-(5-bromopyrimidin-2-yl)methanesulfonamide

InChI: InChI=1S/C5H6BrN3O2S/c1-12(10,11)9-5-7-2-4(6)3-8-5/h2-3H,1H3,(H,7,8,9)

Composition: C (23.82%), H (2.40%), Br (31.70%), N (16.67%), O (12.69%), S (12.72%)

Molar Mass: 252.09

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	250.936411
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	MRNXHECJHFQUDD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.97
Topological Polar Surface Area	71.95
Polarizability	18.85
Ring Count	1
Rotatable Bond Count	1

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