AG003LHC

21314-17-0 | 1-Phenyl-1H-pyrazolo[3，4-d]pyrimidin-4-ol

AG003LHC

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CAS Number	21314-17-0
Catalog Number	AG003LHC(AGN-PC-0O7U9C)
Chemical Name	1-Phenyl-1H-pyrazolo[3，4-d]pyrimidin-4-ol
EC Number	244-331-0
IUPAC Name	1-phenyl-5H-pyrazolo[3,4-d]pyrimidin-4-one
InChI	InChI=1S/C11H8N4O/c16-11-9-6-14-15(10(9)12-7-13-11)8-4-2-1-3-5-8/h1-7H,(H,12,13,16)
InChI Key	GDZQGHGCKKWNAC-UHFFFAOYSA-N
MDL Number	MFCD00082637
Molecular Formula	C11H8N4O
Molecular Weight	212.2074
NSC Number	3954
SMILES	OC1=C2C(N(C3=CC=CC=C3)N=C2)=NC=N1
Synonyms	21314-17-0, 1-Phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-ol, 4-Hydroxy-1-Phenylpyrazolo[3,4-d]pyrimidine, 1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one, 4H-Pyrazolo[3,4-d]pyrimidin-4-one, 1,5-dihydro-1-phenyl-, GDZQGHGCKKWNAC-UHFFFAOYSA-N, MFCD00082637, 1-phenyl-5H-pyrazolo[3,4-d]pyrimidin-4-one, 4-Hydroxy-1-phenylpyrazole[3,4-D]pyrimidine, 1-phenyl-5-hydropyrazolo[5,4-d]pyrimidin-4-one, 1,5-Dihydro-1-phenyl-4H-pyrazolo(3,4-d)pyrimidin-4-one, 1,5-Dihydro-1-phenyl-4H-pyrazolo[3,4-d]pyrimidin-4-one, NSC3954, ACMC-1CMER, AC1L3GNG, ChemDiv3_003049, 1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one, AC1Q6ID1, Oprea1_282390, Oprea1_793342, AC1Q79B5, SCHEMBL2077064, SCHEMBL2362359, CTK4E6427, KS-00001BEL, 1-phenyl-1,2-dihydro-4h-pyrazolo[3,4-d]pyrimidin-4-one, HMS1481K13, HMS1653E08, ALBB-027429, BB_SC-02764, NSC-3954, ZX-AN051682, EINECS 244-331-0, BBL004545, BBL028167, CCG-19662, HTS015149, SBB023760, STK104638, STL373602, ZINC18102616, AKOS000267628, AKOS000269773, CS-W015018, MCULE-3578095694, 1-phenylpyrazolo[3,4-d]pyrimidin-4-ol, ST074295, AB0118678, AB0167621, BC4124030, TC-168804, BB 0242463, EU-0010369, FT-0618618, R3064, 1-Phenyl-1H-pyrazolo[3,4-d]pyrimidine-4-ol, 4-Hydroxy-1-phenylpyrazolo-[3,4d]pyrimidine, L-4542, 1-Phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-ol #, AB00674252-01, 4-Hydroxy-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine, 1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one, 1-phenyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one, BRD-K94622432-001-01-9, 1-Phenyl-1,5-dihydro-pyrazolo[3,4-d]pyrimidi n-4-one, F1386-0037, I14-109343, 4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-1-phenyl-, C11H8N4O, CID88867, AR-1C5164, 21854-95-5,

Complexity	311
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.07g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	212.212g/mol
Monoisotopic Mass	212.07g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	59.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

Lot Number