6-chloro-N-phenyl-1,3,5-triazine-2,4-diamine
Basic information
- CAS
16007-72-0- Standard SMILES
Nc1nc(Cl)nc(Nc2ccccc2)n1- InChIKey
GTWWCOHKWIABRU-UHFFFAOYSA-N- Molecular formula
- C9H8ClN5
- Average molar mass
- 221.64 g/mol
- Monoisotopic mass
- 221.046823
Names & identifiers
- Preferred name
- 6-chloro-N-phenyl-1,3,5-triazine-2,4-diamine
- IUPAC
- 6-chloro-2-N-phenyl-1,3,5-triazine-2,4-diamine
Names & synonyms
16007-72-06-chloro-N-phenyl-1,3,5-triazine-2,4-diamineDTXSID80274828RefChem:308104DTXCID602262846-CHLORO-N2-PHENYL-1,3,5-TRIAZINE-2,4-DIAMINE6-chloro-2-N-phenyl-1,3,5-triazine-2,4-diaminestarbld0013437CBDivE_014580CHEMBL3086706RAA00772AKOS003672160
Show more names
CS-0232270EN300-1267157SR-01000195060SR-01000195060-16-Chloro-N~2~-phenyl-1,3,5-triazine-2,4-diamine3-(4-amino-6-chloro-1,3,5-triazin-2-ylamino) benzene
Database identifiers
- CAS
16007-72-0- PubChem CID
- 27626
- DTXSID
DTXSID80274828- ChEMBL
CHEMBL3086706- Nikkaji
- J1.557.037G
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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