2D Structure

6-chloro-3-methylquinazolin-4(3H)-one


  • SKU Code: CH141372
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Chemical Name - 6-chloro-3-methylquinazolin-4(3H)-one
Mol Weight - 194.621
Smiles - CN(C=Nc(cc1)c2cc1Cl)C2=O
Property Name Property Value
Mol Name6-chloro-3-methylquinazolin-4(3H)-one
Molweight194.621
Monoisotopic Mass194.02469
Clogp1.4199
Clogs-2.578
H Acceptors3
Total Surface Area140.25
Relative Psa0.20036
Polar Surface Area32.67
Druglikeness3.0994
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.53846
Molecular Flexibility0.17114
Molecular Complexity0.72591
Fragments1
Non H Atoms13
Non Ch Atoms4
Electronegative Atoms4
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms1
Amides1
SmilesCN(C=Nc(cc1)c2cc1Cl)C2=O
InChIKeyInChI=1S/C9H7ClN2O/c1-12-5-11-8-3-2-6(10)4-7(8)9(12)13/h2-5H,1H3
InChIBUKIKWILDICXKB-UHFFFAOYSA-N

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