2-Amino-6-chloro-4-phenylquinoline-3-carbonitrile

HCID 268604

Notes Reactions

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Basic information

CAS: 31407-27-9
Standard SMILES: N#Cc1c(N)nc2ccc(Cl)cc2c1-c1ccccc1
InChIKey: UBEKCEMXDFJEDN-UHFFFAOYSA-N
Molecular formula: C16H10ClN3
Average molar mass: 279.72 g/mol
Monoisotopic mass: 279.056325

Names & identifiers

Preferred name: 2-Amino-6-chloro-4-phenylquinoline-3-carbonitrile
IUPAC: 2-amino-6-chloro-4-phenylquinoline-3-carbonitrile

Names & synonyms

2-amino-6-chloro-4-phenylquinoline-3-carbonitrile31407-27-9DTXSID20296347RefChem:255804DTXCID702474852-amino-3-cyano-4-phenyl-6-chloroquinolineNSC108905Maybridge1_000677SCHEMBL3319793HMS543G17UBEKCEMXDFJEDN-UHFFFAOYSA-NGBA40727

Show more names

CCG-45026NSC-108905SB71302DB-292644NS00017765EN300-17196872-amino-6-chloro-4-phenyl-3-quinolinecarbonitrileAE-473/30088052

Database identifiers

CAS: 31407-27-9
PubChem CID: 268604
DTXSID: DTXSID20296347

Properties

Computed structural properties

XLogP: 4.4
Topological polar surface area: 62.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 20
Formal charge: 0
Complexity: 384

Related reactions

2 records

New reaction record

HRID 538746As productuspto-grants-2014_10

HRID 1184031As productuspto-grants-2014_03

Compound notes

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