(2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide

C11H11BrN2OS — CID 20768861

IUPAC(2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide
SMILESBr.C[C@@H]1Cn2c(nc(=O)c3ccccc32)S1
InChIInChI=1S/C11H10N2OS.BrH/c1-7-6-13-9-5-3-2-4-8(9)10(14)12-11(13)15-7;/h2-5,7H,6H2,1H3;1H/t7-;/m1./s1
InChIKeyJAUBFFIDDLJMBG-OGFXRTJISA-N
MW299.19 g/mol
LogP2.47
Rot. Bonds

About (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide

(2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide (PubChem CID 20768861) has the molecular formula C11H11BrN2OS and a molecular weight of 299.19 g/mol. Its IUPAC name is (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide.

Molecular Properties

Compound Name(2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide
PubChem CID20768861
Molecular FormulaC11H11BrN2OS
Molecular Weight299.19 g/mol
Exact Mass297.98
IUPAC Name(2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide
SMILESBr.C[C@@H]1Cn2c(nc(=O)c3ccccc32)S1
InChIInChI=1S/C11H10N2OS.BrH/c1-7-6-13-9-5-3-2-4-8(9)10(14)12-11(13)15-7;/h2-5,7H,6H2,1H3;1H/t7-;/m1./s1
InChIKeyJAUBFFIDDLJMBG-OGFXRTJISA-N
XLogP2.47
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.19
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide?
The IUPAC name of (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide (CID 20768861) is (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide.
What is the SMILES notation for (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide?
The canonical SMILES for (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide is Br.C[C@@H]1Cn2c(nc(=O)c3ccccc32)S1.
What is the InChIKey of (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide?
The InChIKey is JAUBFFIDDLJMBG-OGFXRTJISA-N. The full InChI is InChI=1S/C11H10N2OS.BrH/c1-7-6-13-9-5-3-2-4-8(9)10(14)12-11(13)15-7;/h2-5,7H,6H2,1H3;1H/t7-;/m1./s1.
What are the key properties of (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide?
(2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide has a molecular weight of 299.19 g/mol, XLogP of 2.47, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1,2-dihydro-[1,3]thiazolo[3,2-a]quinazolin-5-one;hydrobromide is sourced from PubChem (CID 20768861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).