6-iodo-N-phenylquinazolin-4-amine

Substructure search Find similar structures

Basic information

CAS: 455887-98-6
Standard SMILES: Ic1ccc2ncnc(Nc3ccccc3)c2c1
InChIKey: GASBYYVOUWGWTB-UHFFFAOYSA-N
Molecular formula: C14H10IN3
Average molar mass: 347.15 g/mol
Monoisotopic mass: 346.99194

Names & identifiers

Preferred name: 6-iodo-N-phenylquinazolin-4-amine
IUPAC: 6-iodo-N-phenylquinazolin-4-amine

Names & synonyms

6-iodo-N-phenylquinazolin-4-amine455887-98-66-iodo-4-anilinoquinazolineNeuro1_000160Oprea1_802226SCHEMBL1192879SCHEMBL29971755DTXSID60352375GASBYYVOUWGWTB-UHFFFAOYSA-N6-iodo-N-phenyl-4-quinazolinamine(6-iodoquinazolin-4-yl)phenylamineAKOS002257755

Show more names

N-(6-iodo-4-quinazolinyl)-N-phenylamineST50196114AP-906/41472582SR-01000260442SR-01000260442-1

Database identifiers

CAS: 455887-98-6
PubChem CID: 724840
DTXSID: DTXSID60352375
Nikkaji: J3.372.559K

Properties

Computed structural properties

XLogP: 4.1
Topological polar surface area: 37.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 18
Formal charge: 0
Complexity: 268

Related reactions

1 records

New reaction record

HRID 1881670As productuspto-grants-2012_11

Compound notes

Loading…