Basic information
- CAS
24849-96-5- Standard SMILES
CC1(C)N=C(N)N=C(N)N1c1cccc(Br)c1- InChIKey
KOOABGSEBLNWKJ-UHFFFAOYSA-N- Molecular formula
- C11H14BrN5
- Average molar mass
- 296.17 g/mol
- Monoisotopic mass
- 295.04326
Names & identifiers
- Preferred name
- 1,3,5-Triazine-2,4-diamine, 1-(3-bromophenyl)-1,6-dihydro-6,6-dimethyl-
- IUPAC
- 1-(3-bromophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
Names & synonyms
24849-96-5X 491,3,5-Triazine-2,4-diamine, 1-(3-bromophenyl)-1,6-dihydro-6,6-dimethyl-D 91NSC 30821-(3-bromophenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamineCHEMBL268088NSC3082NSC-3082A9X5HV65HPSCHEMBL14577798DTXSID60179549
Show more names
BDBM504050661-(3-bromophenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine1-(3-Bromophenyl)-1,6-dihydro-6,6-dimethyl-1,3,5-triazine-2,4-diamine2,4-Diamino-1-(m-bromophenyl)-1,6-dihydro-6,6-dimethyl-1,3,5-triazines-Triazine, 4,6-diamino-1-(m-bromophenyl)-1,2-dihydro-2,2-dimethyl-
Database identifiers
- CAS
24849-96-5- PubChem CID
- 407235
- DTXSID
DTXSID60179549- ChEMBL
CHEMBL268088- UNII
- A9X5HV65HP
- Nikkaji
- J325.396A
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 363
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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