Basic information
- CAS
72042-09-2- Standard SMILES
Cc1cc(NC(=NC2CCCCC2)Nc2ccccc2)c2ccccc2n1- InChIKey
LCDXWTNJOFQYLS-UHFFFAOYSA-N- Molecular formula
- C23H26N4
- Average molar mass
- 358.5 g/mol
- Monoisotopic mass
- 358.21574685
Names & identifiers
- Preferred name
- Guanidine, 1-cyclohexyl-2-(2-methyl-4-quinolyl)-3-phenyl-
- IUPAC
- 2-cyclohexyl-1-(2-methylquinolin-4-yl)-3-phenylguanidine
Names & synonyms
BRN 56195361-Cyclohexyl-2-(2-methyl-4-quinolyl)-3-phenylguanidine72042-09-2GUANIDINE, 1-CYCLOHEXYL-2-(2-METHYL-4-QUINOLYL)-3-PHENYL-DTXSID80222369RefChem:346889DTXCID30144860CHEMBL61111N''-Cyclohexyl-N-(2-methylquinolin-4-yl)-N'-phenylguanidine
Database identifiers
- CAS
72042-09-2- PubChem CID
- 51530
- DTXSID
DTXSID80222369- ChEMBL
CHEMBL61111- Nikkaji
- J78.483D
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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