chempirical

2,4-Dichloro-5,6,7,8-tetrahydroquinazoline

C8H8Cl2N2CAS 1127-85-1203.07 g/mol

Open in Covalent MOL file
NNClCl
Aryl halide

Properties

Molecular formula
C8H8Cl2N2
Molar mass
203.07 g/mol
Exact mass
202.0065 Da
logP
2.66Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
1127-85-1
SMILES
C1CCC2=C(C1)C(=NC(=N2)Cl)Cl
InChIKey
KBAXPKVNVXMVKV-UHFFFAOYSA-N
InChI
InChI=1S/C8H8Cl2N2/c9-7-5-3-1-2-4-6(5)11-8(10)12-7/h1-4H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline

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

2,4,5,6-Tetrachloropyrimidine1780-40-141 % similar 2,4,6,8-Tetrachloropyrimido[5,4-D]pyrimidine32980-71-541 % similar Cyanuric chloride108-77-033 % similar 1,2,3,4,5,6,7,8-Octahydroacridine1658-08-833 % similar 2,4-Dichloroquinazoline607-68-132 % similar 5,6,7,8-Tetrahydroquinoxaline34413-35-932 % similar 6-Bromo-2,4-dichloroquinazoline102393-82-832 % similar 7-Bromo-2,4-dichloroquinazoline959237-68-432 % similar

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

Elsewhere

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