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Pyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-6(7H)-one

HCID 178786205
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Basic information

CAS
148191-54-2
Standard SMILES
O=c1[nH]ccc2c1cnc1ccnn12
InChIKey
UZIKPIHZEPEKNM-UHFFFAOYSA-N
Molecular formula
C9H6N4O
Average molar mass
186.17 g/mol
Monoisotopic mass
186.05416083

Names & identifiers

Preferred name
Pyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-6(7H)-one
IUPAC
2,3,7,11-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,12-pentaen-10-one
English name
Pyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-6(7H)-one
Molecular formula
C9H6N4O
Molecular weight
186.17

Names & synonyms

Pyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-6(7H)-one148191-54-2MFCD138162222,3,7,11-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,12-pentaen-10-one2,3,7,11-TETRAAZATRICYCLO[7.4.0.0(2),?]TRIDECA-1(9),3,5,7,12-PENTAEN-10-ONEALBB-016904SBB051602STL198015STL576922AKOS002682431AKOS037629198CCG-323954
Show more names
7H-1,4,7,9b-Tetraaza-cyclopenta[a]naphthalen-6-one
LS-05327CS-0080971H31784pyrazolo[1,5-a]pyrido[3,4-e]pyrimidin-6-ol7,10-dihydropyrazolo[1,5-a]pyridino[3,4-e]pyrimidin-6-one

Database identifiers

CAS
148191-54-2
PubChem CID
135469291

Properties

Computed structural propertiesFilling in

XLogP
-0.2
Topological polar surface area
59.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
14
Formal charge
0
Complexity
291

Physicochemical properties

HazardClass
IRRITANT

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hazard_class
IRRITANT

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Compound notes

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