2-(3-Amino-6-propylaminophenyl)-5-(3-methyl-4-chlorophenyl)benzoxazole

HCID 21884472
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Basic information

Standard SMILES
CCCNc1ccc(N)cc1-c1nc2cc(-c3ccc(Cl)c(C)c3)ccc2o1
InChIKey
ARGFPWHFKOQKPK-UHFFFAOYSA-N
Molecular formula
C23H22ClN3O
Average molar mass
391.9 g/mol
Monoisotopic mass
391.14514

Names & identifiers

Preferred name
2-(3-Amino-6-propylaminophenyl)-5-(3-methyl-4-chlorophenyl)benzoxazole
IUPAC
2-[5-(4-chloro-3-methylphenyl)-1,3-benzoxazol-2-yl]-1-N-propylbenzene-1,4-diamine

Names & synonyms

SCHEMBL5835189ARGFPWHFKOQKPK-UHFFFAOYSA-N2-(3-Amino-6-propylaminophenyl)-5-(3-methyl-4-chlorophenyl)benzoxazole

Database identifiers

PubChem CID
21884472

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
64.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
28

Related reactions

3 records
New reaction record

Compound notes

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