1-(2-aminopyrimidin-4-yl)-6-bromo-N-(2-methoxyethyl)-1H-1,3-benzodiazol-2-amine

HCID 68181733
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Basic information

Standard SMILES
COCCNc1nc2ccc(Br)cc2n1-c1ccnc(N)n1
InChIKey
QBIFANTXJLZASP-UHFFFAOYSA-N
Molecular formula
C14H15BrN6O
Average molar mass
363.21 g/mol

Names & identifiers

Preferred name
1-(2-aminopyrimidin-4-yl)-6-bromo-N-(2-methoxyethyl)-1H-1,3-benzodiazol-2-amine
IUPAC
1-(2-aminopyrimidin-4-yl)-6-bromo-N-(2-methoxyethyl)benzimidazol-2-amine

Names & synonyms

SCHEMBL11970750QBIFANTXJLZASP-UHFFFAOYSA-N1-(2-aminopyrimidin-4-yl)-6-bromo-N-(2-methoxyethyl)-1H-1,3-benzodiazol-2-amine

Database identifiers

PubChem CID
68181733

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
90.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
22

Related reactions

5 records
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Compound notes

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