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Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl-

HCID 3073769
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Basic information

CAS
152423-13-7
Standard SMILES
Cn1ncc2c(=O)n3c(-c4ccccc4)csc3nc21
InChIKey
AKVOIQHFRCVCAF-UHFFFAOYSA-N
Molecular formula
C14H10N4OS
Average molar mass
282.32 g/mol
Monoisotopic mass
282.05753213

Names & identifiers

Preferred name
Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl-
IUPAC
6-methyl-12-phenyl-10-thia-1,5,6,8-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),4,8,11-tetraen-2-one

Names & synonyms

Pyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one, 1-methyl-6-phenyl-1-Methyl-6-phenylpyrazolo(3,4-d)thiazolo(3,2-a)pyrimidin-4(1H)-one152423-13-7DTXSID20165024RefChem:376269DTXCID60875151-Methyl-6-phenylpyrazolo[3,4-d][1,3]thiazolo[3,2-a]pyrimidin-4(1H)-one

Database identifiers

CAS
152423-13-7
PubChem CID
3073769
DTXSID
DTXSID20165024
Nikkaji
J551.027I

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
75.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
20
Formal charge
0
Complexity
497

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