5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide

C10H9BrN2OS — CID 18531648

IUPAC5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide
SMILESBr.O=C1CSC2=Nc3ccccc3CN12
InChIInChI=1S/C10H8N2OS.BrH/c13-9-6-14-10-11-8-4-2-1-3-7(8)5-12(9)10;/h1-4H,5-6H2;1H
InChIKeyPZYPMFWDVKUWFI-UHFFFAOYSA-N
MW285.17 g/mol
LogP2.34
Rot. Bonds

About 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide

5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide (PubChem CID 18531648) has the molecular formula C10H9BrN2OS and a molecular weight of 285.17 g/mol. Its IUPAC name is 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide.

Molecular Properties

Compound Name5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide
PubChem CID18531648
Molecular FormulaC10H9BrN2OS
Molecular Weight285.17 g/mol
Exact Mass283.96
IUPAC Name5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide
SMILESBr.O=C1CSC2=Nc3ccccc3CN12
InChIInChI=1S/C10H8N2OS.BrH/c13-9-6-14-10-11-8-4-2-1-3-7(8)5-12(9)10;/h1-4H,5-6H2;1H
InChIKeyPZYPMFWDVKUWFI-UHFFFAOYSA-N
XLogP2.34
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.17
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminophenyl)-5H-[1,3]thiazolo[2,3-b]quinazolin-3-one
CID 21090613
5H-[1,3]thiazolo[2,3-b]quinazoline;dihydrochloride
CID 169005273
2-chloro-3-phenyl-4H-quinazoline
CID 174952978
1-cyclohexyl-3,6-dihydro-2H-pyrimido[2,1-b]quinazolin-4-one
CID 10902113
3-phenyl-2,4-dihydro-[1,3]thiazolo[3,2-a][1,3,5]triazin-6-one
CID 570559
2-methyl-3-(2-methylphenyl)-4H-quinazoline
CID 174924725
2-(4-benzhydrylpiperazin-4-ium-1-yl)-4H-3,1-benzothiazine
CID 7033077
3-(3,5-dihydro-2H-[1,3]thiazolo[2,3-b]quinazolin-3-yl)phenol
CID 58819985
2,8-dihydro-1H-azeto[2,1-b]quinazoline
CID 15852512
2-(4-methylphenyl)-3-phenyl-4H-quinazoline
CID 174881000
2-fluoro-3H-indole
CID 174790270
(2R,3R)-2-hydroxy-3-methyl-2-(trifluoromethyl)-3,9-dihydropyrrolo[2,1-b]quinazolin-1-one
CID 71605339

Frequently Asked Questions

What is the IUPAC name of 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide?
The IUPAC name of 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide (CID 18531648) is 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide.
What is the SMILES notation for 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide?
The canonical SMILES for 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide is Br.O=C1CSC2=Nc3ccccc3CN12.
What is the InChIKey of 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide?
The InChIKey is PZYPMFWDVKUWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2OS.BrH/c13-9-6-14-10-11-8-4-2-1-3-7(8)5-12(9)10;/h1-4H,5-6H2;1H.
What are the key properties of 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide?
5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide has a molecular weight of 285.17 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-[1,3]thiazolo[2,3-b]quinazolin-3-one;hydrobromide is sourced from PubChem (CID 18531648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).