(6-benzoyl-2-pyridyl)methyl 2-[N-(2-chloro-2-propenyl)amino]-3-methylbutanoate

HCID 20461185
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Basic information

Standard SMILES
C=C(Cl)CNC(C(=O)OCc1cccc(C(=O)c2ccccc2)n1)C(C)C
InChIKey
ZZTNYBJRHHIEKO-UHFFFAOYSA-N
Molecular formula
C21H23ClN2O3
Average molar mass
386.9 g/mol

Names & identifiers

Preferred name
(6-benzoyl-2-pyridyl)methyl 2-[N-(2-chloro-2-propenyl)amino]-3-methylbutanoate
IUPAC
(6-benzoyl-2-pyridinyl)methyl 2-(2-chloroprop-2-enylamino)-3-methylbutanoate

Names & synonyms

SCHEMBL11064786ZZTNYBJRHHIEKO-UHFFFAOYSA-N(6-benzoyl-2-pyridyl)methyl 2-[N-(2-chloro-2-propenyl)amino]-3-methylbutanoate

Database identifiers

PubChem CID
20461185

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
68.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
27

Related reactions

3 records
New reaction record

Linked notes

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