3-(6-bromo-5-(4-chlorobenzyl)-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)propyl formate

HCID 118875889
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Basic information

Standard SMILES
Cn1c(=O)n(CCCOC=O)c(=O)c2c(Cc3ccc(Cl)cc3)c(Br)cnc21
InChIKey
VJGJHHOAGGIOFR-UHFFFAOYSA-N
Molecular formula
C19H17BrClN3O4
Average molar mass
466.7 g/mol

Names & identifiers

Preferred name
3-(6-bromo-5-(4-chlorobenzyl)-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)propyl formate
IUPAC
3-[6-bromo-5-[(4-chlorophenyl)methyl]-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidin-3-yl]propyl formate

Names & synonyms

SCHEMBL17509556VJGJHHOAGGIOFR-UHFFFAOYSA-N3-(6-bromo-5-(4-chlorobenzyl)-1-methyl-2,4-dioxo-1,2-dihydropyrido[2,3-d]pyrimidin-3(4H)-yl)propyl formate

Database identifiers

PubChem CID
118875889

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
79.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
28

Related reactions

8 records
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Compound notes

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