Bitpa
Basic information
- CAS
3602-01-5- Standard SMILES
O=C(Nc1ccc(C2=NCCN2)cc1)c1ccc(C(=O)Nc2ccc(C3=NCCN3)cc2)cc1- InChIKey
YMKGYWQAKWKNTM-UHFFFAOYSA-N- Molecular formula
- C26H24N6O2
- Average molar mass
- 452.5 g/mol
- Monoisotopic mass
- 452.19607403
Names & identifiers
- Preferred name
- Bitpa
- IUPAC
- 1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,4-dicarboxamide
Names & synonyms
BITPAHR 21973602-01-54',4''-Di-2-imidazolin-2-ylterephthalanilideNSC-59503Terephthalanilide, 4',4''-di-2-imidazolin-2-yl-9TE6AK2GECCHEMBL166101SLU-PP-192SCHEMBL15329306DTXSID90189590NSC59503
Show more names
NSC 59503N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,4-dicarboxamideAI3-50640DS-008393Terephthalanilide,4''-bis(2-imidazolin-2-yl)-1, N,N'-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1,4-Benzenedicarboxamide, N,N'-bis(4-(4,5-dihydro-1H-imidazol-2-yl)phenyl)-1,4-Benzenedicarboxamide, n,n-bis[4-(4, 5-dihydro-1h-imidazol-2-yl)phenyl]-
Database identifiers
- CAS
3602-01-5- PubChem CID
- 21334
- DTXSID
DTXSID90189590- ChEMBL
CHEMBL166101- UNII
- 9TE6AK2GEC
- Nikkaji
- J439.242F
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 721
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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