AG007PJB

221244-14-0 | PP1 Analog II, 1NM-PP1

AG007PJB

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CAS Number	221244-14-0
Catalog Number	AG007PJB(AGN-PC-0QYRGR)
Chemical Name	PP1 Analog II, 1NM-PP1
IUPAC Name	1-tert-butyl-3-(naphthalen-1-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine
InChI	InChI=1S/C20H21N5/c1-20(2,3)25-19-17(18(21)22-12-23-19)16(24-25)11-14-9-6-8-13-7-4-5-10-15(13)14/h4-10,12H,11H2,1-3H3,(H2,21,22,23)
InChI Key	GDQXJQSQYMMKRA-UHFFFAOYSA-N
MDL Number	MFCD17010191
Molecular Formula	C20H21N5
Molecular Weight	331.4142
SMILES	NC1=C2C(N(C(C)(C)C)N=C2CC3=C4C=CC=CC4=CC=C3)=NC=N1
Synonyms	4-amino-1-tert-butyl-3-(1'-naphthylmethyl)pyrazolo(3,4-d)pyrimidine, 4-amino-tBuNMPP, 1-NM-PP1, 221244-14-0, PP1 Analog II, 1NM-PP1, 1-tert-butyl-3-(naphthalen-1-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, NM-PP1, Mutant Kinases Inhibitor II, 1 NM-PP1, 1NM-PP1(PP1 Analog II), PP1 ANALOG II, AC1NP9I6, 4-Amino-1-tert-butyl-3-(1'-naphthylmethyl)pyrazolo[3,4-d]pyrimidine, CHEMBL573578, CHEBI:52309, 1-(tert-butyl)-3-(naphthalen-1-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, MMV676599, 1-(1,1-dimethylethyl)-3-(1-naphthalenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, W-201917, C20H21N5, 1-tert-butyl-3-(naphthalen-1-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine, 4-Amino-1-tert-butyl-3-(1′-naphthylmethyl)pyrazolo[3,4-d]pyrimidine, 956025-48-2, 4gki, 4lgh, 0JN, 1-Naphthylmethyl-PP1, MLS001065852, GTPL6028, SCHEMBL1964002, CTK8E9533, DTXSID30408954, EX-A868, GDQXJQSQYMMKRA-UHFFFAOYSA-N, HMS2209D11, HMS3229K05, HMS3329N11, HMS3648M20, BCP09491, 1408AH, BDBM50298225, IN1142, MFCD17010191, ZINC13132888, AKOS025149625, CCG-206782, CS-1805, MB69432, KS-00001D84, NCGC00168082-01, AK175694, HY-13942, QC-11663, SMR000486341, AB0199570, RT-015123, FT-0661644, A13573, 835B560, SR-01000781016, SR-01000781016-2, 1-tert-butyl-3-(1-naphthylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine, 4-amino-1-t-butyl-3-(1'-naphthylmethyl)pyrazolo[3,4-d]pyrimidine, 1-tert-Butyl-3-(naphthalen-1-ylmethyl)pyrazolo[4,5-e]pyrimidin-4-amine, 1-tert-Butyl-3-naphthalen-1-ylmethyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylamine, 1-NAPHTHYL PP1, D0GT8N, CHEMBL2069955, CID5154691, B1299, NM, 7-(naphthalen-1-ylmethyl)-9-tert-butyl-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,5,7-tetraen-5-amine,

Complexity	462
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	331.18g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	331.423g/mol
Monoisotopic Mass	331.18g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	69.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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