CAS
94696-72-7 Purity
96%
94696-72-7 Purity
96%
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Specification
The molecular formula is C11H8N2S.
The compound was first created on May 27, 2009.
The molecular weight is 200.26 g/mol.
The IUPAC Name is 2-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridine.
The Canonical SMILES is C1=CC2=C(NC(=C2)C3=CC=CS3)N=C1.
The compound has 1 hydrogen bond donor count.
The XLogP3-AA value is 2.7.
The topological polar surface area is 56.9 Ų.
No, the compound has 0 defined atom stereocenter count.
Yes, the compound is canonicalized.