AG00APP1

152120-55-3 | N,N'-Bis-Z-1-Guanylpyrazole

AG00APP1

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CAS Number	152120-55-3
Catalog Number	AG00APP1(AGN-PC-0Q69AS)
Chemical Name	N,N'-Bis-Z-1-Guanylpyrazole
IUPAC Name	benzyl (NZ)-N-[phenylmethoxycarbonylamino(pyrazol-1-yl)methylidene]carbamate
InChI	InChI=1S/C20H18N4O4/c25-19(27-14-16-8-3-1-4-9-16)22-18(24-13-7-12-21-24)23-20(26)28-15-17-10-5-2-6-11-17/h1-13H,14-15H2,(H,22,23,25,26)
InChI Key	NRBUVVTTYMTSKM-UHFFFAOYSA-N
MDL Number	MFCD02092983
Molecular Formula	C20H18N4O4
Molecular Weight	378.3813
SMILES	C1=CC=C(C=C1)COC(N=C(N=C(O)OCC2=CC=CC=C2)[N]3C=CC=N3)=O
Synonyms	N,N'-BIS-Z-1-GUANYLPYRAZOLE, 152120-55-3, Benzyl ((((benzyloxy)carbonyl)amino)(1H-pyrazol-1-yl)methylene)carbamate, N,N'-Bis(benzyloxycarbonyl)-1H-pyrazole-1-carboxamidine, MFCD02683516, N,N-BISBENZYLOXYCARBONYL-1-GUANYLPYRAZOLE, pyrazole(z)2, pyrazol(z)2, N,N'-Bis(carbobenzoxy)-1H-pyrazole-1-carboxamidine, AC1O4LH2, N,N'-Bs-Z-1-guanylpyrazole, SCHEMBL670164, N,N;-Bis-Z-1-Guanylpyrazole, DTXSID20422902, N,N'-Di-Cbz-1H-pyrazole-1-carbo, 1-[N,N'-(Di-Cbz)amidino]pyrazole, MFCD02092983, n,n'-di-z-1h-pyrazol-1-carbamidine, AKOS007930853, AKOS025117323, AM84479, CS-W008067, N,N'-di-Z-1H-pyrazole-1-carbamidine, RL01942, RTR-006263, N,N\\'-BIS-Z-1-GUANYLPYRAZOLE, AS-11122, BR-47481, n,n-bis(benzyloxycarbonyl)-1h-pyrazole-1, N,N'-Di-Cbz-1H-pyrazole-1-carboxamidine, 1-[N,N'-Bis(carbobenzoxy)amidino]pyrazole, AB0008727, M-1088, 120B553, J-008886, J-523221, S14-1524, N,N'-Bis(carbobenzoxy)-1H-pyrazole-1-carboximidamide, N,N\'-Bis(benzyloxycarbonyl)-1H-pyrazole-1-carboxamidine, benzyl (NZ)-N-[phenylmethoxycarbonylamino(pyrazol-1-yl)methylidene]carbamate, benzyl N-[(1Z)-{[(benzyloxy)carbonyl]imino}(pyrazol-1-yl)methyl]carbamate, n,n-bisbenzyloxycarbonyl-1-guanylpyrazole, n,n-di-cbz-1h-pyrazole-1-carboxamidine, C20H18N4O4, N,N'-Di-Cbz-pyrazole-1-carboxamidine, CID6371643, B3605, N,N'-Bis(carbobenzoxy)-1H-pyrazole-1-carboxamidine, 98% - 1G 1g, Benzyl N-(N-phenylmethoxycarbonyl-C-pyrazol-1-yl-carbonimidoyl)carbamate, 2556-73-2,

Complexity	542
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	378.133g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	378.388g/mol
Monoisotopic Mass	378.133g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	94.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
Signal Words	warning
UN Code

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