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7-methanesulfonylquinolin-3-amine

7-methanesulfonylquinolin-3-amine

CAS: 944401-82-5

Formula: C10H10N2O2S

SMILES: CS(=O)(=O)C1=CC=C2C=C(N)C=NC2=C1

IUPAC: 7-methanesulfonylquinolin-3-amine

InChI: InChI=1S/C10H10N2O2S/c1-15(13,14)9-3-2-7-4-8(11)6-12-10(7)5-9/h2-6H,11H2,1H3

Composition: C (54.04%), H (4.54%), N (12.60%), O (14.40%), S (14.42%)

Molar Mass: 222.26

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 222.046298744
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey XAEZFBGIRMELPG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.68
Topological Polar Surface Area 73.05
Polarizability 24.06
Ring Count 2
Rotatable Bond Count 1

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