tert-Butyl 4-chloro-8-methyl-5,8-dihydropyrido[3,4-d]pyrimidine-7(6H)-carboxylate

HCID 59394669

Basic information

Standard SMILES
CC1c2ncnc(Cl)c2CCN1C(=O)OC(C)(C)C
InChIKey
KTGMTIWZYVAETA-UHFFFAOYSA-N
Molecular formula
C13H18ClN3O2
Average molar mass
283.75 g/mol

Names & identifiers

Preferred name
tert-Butyl 4-chloro-8-methyl-5,8-dihydropyrido[3,4-d]pyrimidine-7(6H)-carboxylate
IUPAC
tert-butyl 4-chloro-8-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylate

Names & synonyms

1229455-24-6tert-Butyl 4-chloro-8-methyl-5,8-dihydropyrido[3,4-d]pyrimidine-7(6H)-carboxylatetert-butyl 4-chloro-8-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxylateSCHEMBL2793266KTGMTIWZYVAETA-UHFFFAOYSA-NDB-160370(+/-)-4-Chloro-8-methyl-5,8-dihydro-6H-pyrido[3,4-d]pyrimidine-7-carboxylic acid tert-butyl ester4-chloro-8-methyl-5,8-dihydro-6H-pyrido[3,4-d]pyrimidine-7-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
59394669

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
55.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
19

Related reactions

12 records

Linked notes

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