chempirical

2,4,7-Trichloropyrido[2,3-D]pyrimidine

C7H2Cl3N3CAS 938443-20-0234.46 g/mol

Open in Covalent MOL file
ClClNClNN
Aryl halide

Properties

Molecular formula
C7H2Cl3N3
Molar mass
234.46 g/mol
Exact mass
232.9314 Da
logP
2.98Crippen estimate
Polar surface area
38.7 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Identifiers

CAS number
938443-20-0
SMILES
Clc1ccc2c(Cl)nc(Cl)nc2n1
InChIKey
DNFDLCRLLQVUQK-UHFFFAOYSA-N
InChI
InChI=1S/C7H2Cl3N3/c8-4-2-1-3-5(9)12-7(10)13-6(3)11-4/h1-2H

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Names and synonyms

1 names
  • Pyrido[2,3-d]pyrimidine, 2,4,7-trichloro-

Work with 2,4,7-Trichloropyrido[2,3-D]pyrimidine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4-Dichloro-pyrido[2,3-d]pyrimidine126728-20-958 % similar 2,4-Dichloroquinazoline607-68-148 % similar 2,3,6-Trichloropyridine6515-09-943 % similar 2,4-Dichlorothieno[2,3-D]pyrimidine18740-39-142 % similar 7-Bromo-2,4-dichloroquinazoline959237-68-442 % similar 1,3-Dichloroisoquinoline7742-73-641 % similar 2,6-Dichloro-3-pyridinamine62476-56-641 % similar 2,4,6-Trichloroquinazoline20028-68-640 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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