4,6-Diamino-1,2-dihydro-1-(2,4,5-trichlorophenylmethoxy)-2,2-dimethyl-1,3,5-triazine hydrobromide

HCID 19089962
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Basic information

Standard SMILES
Br.CC1(C)N=C(N)N=C(N)N1OCc1cc(Cl)c(Cl)cc1Cl
InChIKey
KCKIJAFKOXNYLB-UHFFFAOYSA-N
Molecular formula
C12H15BrCl3N5O
Average molar mass
431.5 g/mol
Monoisotopic mass
428.95256

Names & identifiers

Preferred name
4,6-Diamino-1,2-dihydro-1-(2,4,5-trichlorophenylmethoxy)-2,2-dimethyl-1,3,5-triazine hydrobromide
IUPAC
6,6-dimethyl-1-[(2,4,5-trichlorophenyl)methoxy]-1,3,5-triazine-2,4-diamine;hydrobromide

Names & synonyms

SCHEMBL9395252KCKIJAFKOXNYLB-UHFFFAOYSA-N4,6-diamino-1,2-dihydro-1-(2,4,5-trichlorophenylmethoxy)-2,2-dimethyl-1,3,5-triazine hydrobromide

Database identifiers

PubChem CID
19089962

Properties

Computed structural properties

Topological polar surface area
89.2 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
22

Related reactions

2 records
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Compound notes

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