methyl 2-[2-amino-6-(2,6-dichlorophenyl)-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-8-yl]acetate

HCID 5328629
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Basic information

Standard SMILES
COC(=O)Cn1c(=O)c(-c2c(Cl)cccc2Cl)cc2cnc(N)nc21
InChIKey
KNIFQDAVGJMBRW-UHFFFAOYSA-N
Molecular formula
C16H12Cl2N4O3
Average molar mass
379.2 g/mol

Names & identifiers

Preferred name
methyl 2-[2-amino-6-(2,6-dichlorophenyl)-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-8-yl]acetate
IUPAC
methyl 2-[2-amino-6-(2,6-dichlorophenyl)-7-oxopyrido[2,3-d]pyrimidin-8-yl]acetate

Names & synonyms

pyrido[2,3-d]pyrimidin-7-one deriv. 9BDBM4054CHEMBL136457SCHEMBL5766081KNIFQDAVGJMBRW-UHFFFAOYSA-Nmethyl 2-[2-amino-6-(2,6-dichlorophenyl)-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-8-yl]acetate[2-amino-6-(2,6-dichlorophenyl)-7-oxo-7H-pyrido[2,3-d]pyrimidin-8-yl]-acetic acid methyl ester2-Amino-6-(2,6-dichlorophenyl)-7-oxo-7H-pyrido[2,3-d]pyrimidin-8-yl]acetic acid methyl ester

Database identifiers

PubChem CID
5328629
ChEMBL
CHEMBL136457
Nikkaji
J1.028.063J

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
98.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

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