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2-{[1,2]thiazolo[4,5-c]pyridine-4-sulfonamido}propanoic acid

2-{[1,2]thiazolo[4,5-c]pyridine-4-sulfonamido}propanoic acid

CAS: 1396966-20-3

Formula: C9H9N3O4S2

SMILES: CC(NS(=O)(=O)C1=C2C=NSC2=CC=N1)C(O)=O

IUPAC: 2-{[1,2]thiazolo[4,5-c]pyridine-4-sulfonamido}propanoic acid

InChI: InChI=1/C9H9N3O4S2/c1-5(9(13)14)12-18(15,16)8-6-4-11-17-7(6)2-3-10-8/h2-5,12H,1H3,(H,13,14)

Composition: C (37.62%), H (3.16%), N (14.63%), O (22.27%), S (22.32%)

Molar Mass: 287.31

Atom Count: 27

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 287.00344813
Formal Charge 0
FSP3 0.22
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey UNPWESOHXABYIC-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 64.02
Topological Polar Surface Area 109.25
Polarizability 26.24
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 1396966-20-3 $404.27$404.27
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