Basic information
- CAS
1525-17-3- Standard SMILES
Cc1nc(Nc2ccc(F)cc2)nc(Nc2ccc(F)cc2)c1[N+](=O)[O-]- InChIKey
YTMQTNNYLMRBJN-UHFFFAOYSA-N- Molecular formula
- C17H13F2N5O2
- Average molar mass
- 357.31 g/mol
- Monoisotopic mass
- 357.103731
Names & identifiers
- Preferred name
- N2,N4-Bis(4-fluorophenyl)-6-methyl-5-nitropyrimidine-2,4-diamine
- IUPAC
- 2-N,4-N-bis(4-fluorophenyl)-6-methyl-5-nitropyrimidine-2,4-diamine
Names & synonyms
1525-17-3MLS000737599N2,N4-BIS(4-FLUOROPHENYL)-6-METHYL-5-NITROPYRIMIDINE-2,4-DIAMINENSC29200Oprea1_664978CHEMBL1499283DTXSID80934516HMS2759A16NSC-29200AKOS000444223N~2~,N~4~-Bis(4-fluorophenyl)-6-methyl-5-nitropyrimidine-2,4-diamineSMR000393770
Show more names
ST45019051ST50004637SR-01000357695SR-01000357695-1
Database identifiers
- CAS
1525-17-3- PubChem CID
- 232146
- DTXSID
DTXSID80934516- ChEMBL
CHEMBL1499283
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 95.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 465
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…