4-[4-(3-Dimethylamino-benzoylamino)-phenyl]-butyric acid ethyl ester

HCID 67045331
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Basic information

Standard SMILES
CCOC(=O)CCCc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1
InChIKey
ALRLEMUQXZCHEF-UHFFFAOYSA-N
Molecular formula
C21H26N2O3
Average molar mass
354.4 g/mol
Monoisotopic mass
354.1943427

Names & identifiers

Preferred name
4-[4-(3-Dimethylamino-benzoylamino)-phenyl]-butyric acid ethyl ester
IUPAC
ethyl 4-[4-[[3-(dimethylamino)benzoyl]amino]phenyl]butanoate

Names & synonyms

SCHEMBL1468706ALRLEMUQXZCHEF-UHFFFAOYSA-N4-[4-(3-dimethylamino-benzoylamino)-phenyl]-butyric acid ethyl ester

Database identifiers

PubChem CID
67045331

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
58.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
26

Related reactions

1 records
New reaction record

Linked notes

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