BW 458C
Basic information
- CAS
4315-44-0- Standard SMILES
CC1CN=C(c2ccc(NC(=O)c3ccc(C(=O)Nc4ccc(C5=NCC(C)N5)cc4)cc3)cc2)N1.Cl.Cl- InChIKey
MVHALJRIOVBKOX-UHFFFAOYSA-N- Molecular formula
- C28H30Cl2N6O2
- Average molar mass
- 553.5 g/mol
- Monoisotopic mass
- 552.1807296
Overview
Wander 2495 is dimethylsulfonate salt; structure given in first source
Names & identifiers
- Preferred name
- BW 458C
- IUPAC
- 1-N,4-N-bis[4-(5-methyl-4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,4-dicarboxamide;dihydrochloride
Names & synonyms
BW 458C4315-44-0BW-458C1,4-Benzenedicarboxamide, N,N'-bis(4-(4,5-dihydro-4-methyl-1H-imidazol-2-yl)phenyl)-, dihydrochlorideWander-2159Wander-2495RefChem:1224094,4'-Bis(4-methylimidazolin-2-yl)terephthalanilide 2HClWander compound 2159NSC 571481-N,4-N-bis[4-(5-methyl-4,5-dihydro-1H-imidazol-2-yl)phenyl]benzene-1,4-dicarboxamide;dihydrochlorideWander 2159
Show more names
NSC-57148Wander 2495orb3174683GLXC-01729Terephthalanide, 4',4''-bis(4-methyl-2-imidazolin-2-yl)-, dihydrochloride1,4-Benzenedicarbaoxamide, N,N'-bis(4-(4,5-dihydro-4-methyl-1H-imidazol-2-yl)phenyl)-, dihydrochloride
Database identifiers
- CAS
4315-44-0- PubChem CID
- 160747
Properties
Computed structural properties
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 778
Related reactions
0 records
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Compound notes
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