3-(2'-amino-1'-methyl-5'-oxo-2-phenyl-1',5'-dihydrospiro[chroman-4,4'-imidazole]-6-yl)-N-(2-cyanoethyl)benzamide

HCID 67385021
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Basic information

Standard SMILES
CN1C(=O)C2(CC(c3ccccc3)Oc3ccc(-c4cccc(C(=O)NCCC#N)c4)cc32)N=C1N
InChIKey
JBZOJVDKNJLATL-UHFFFAOYSA-N
Molecular formula
C28H25N5O3
Average molar mass
479.5 g/mol

Names & identifiers

Preferred name
3-(2'-amino-1'-methyl-5'-oxo-2-phenyl-1',5'-dihydrospiro[chroman-4,4'-imidazole]-6-yl)-N-(2-cyanoethyl)benzamide
IUPAC
3-(2'-amino-1'-methyl-5'-oxo-2-phenylspiro[2,3-dihydrochromene-4,4'-imidazole]-6-yl)-N-(2-cyanoethyl)benzamide

Names & synonyms

SCHEMBL2375613JBZOJVDKNJLATL-UHFFFAOYSA-N3-(2'-amino-1'-methyl-5'-oxo-2-phenyl-1',5'-dihydrospiro[chroman-4,4'-imidazole]-6-yl)-N-(2-cyanoethyl)benzamide

Database identifiers

PubChem CID
67385021

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
121 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
36

Related reactions

2 records
New reaction record

Linked notes

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