(2-Amino-5-chloro-phenyl)-pyrimidin-2-yl-methanone

HCID 12377814
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Basic information

Standard SMILES
Nc1ccc(Cl)cc1C(=O)c1ncccn1
InChIKey
TYRGAVXBIPMIGQ-UHFFFAOYSA-N
Molecular formula
C11H8ClN3O
Average molar mass
233.65 g/mol
Monoisotopic mass
233.0355896

Names & identifiers

Preferred name
(2-Amino-5-chloro-phenyl)-pyrimidin-2-yl-methanone
IUPAC
(2-amino-5-chlorophenyl)-pyrimidin-2-ylmethanone

Names & synonyms

26440-25-5SCHEMBL343781TYRGAVXBIPMIGQ-UHFFFAOYSA-NDB-388758(2-Amino-5-chlorophenyl)-2-pyrimidinylmethanone(2-Amino-5-chloro-phenyl)-pyrimidin-2-yl-methanone

Database identifiers

PubChem CID
12377814

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
68.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
16

Related reactions

5 records
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Compound notes

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