Basic information
- Standard SMILES
O=C(NCCCn1ccnc1)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1- InChIKey
ZMAYUBVHKQBAIM-UHFFFAOYSA-N- Molecular formula
- C25H21Cl2N5O2
- Average molar mass
- 494.4 g/mol
- Monoisotopic mass
- 493.1072303
Names & identifiers
- Preferred name
- N4-(3-(1H-imidazol-1-yl)propyl)-2-chloro-N1-(4-chloro-3-(pyridin-2-yl)phenyl)terephthalamide
- IUPAC
- 2-chloro-1-N-(4-chloro-3-pyridin-2-ylphenyl)-4-N-(3-imidazol-1-ylpropyl)benzene-1,4-dicarboxamide
Names & synonyms
SCHEMBL2611880SCHEMBL30572176ZMAYUBVHKQBAIM-UHFFFAOYSA-NN4-(3-(1H-imidazol-1-yl)propyl)-2-chloro-N1-(4-chloro-3-(pyridin-2-yl)phenyl)terephthalamide
Database identifiers
- PubChem CID
- 58614932
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 88.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 684
Related reactions
4 records
Compound notes
Loading…