AG00048G

101328-85-2 | 3(2H)-Pyridazinone, 6-(4-aminophenyl)-4,5-dihydro-5-methyl-, (5R)-

AG00048G

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CAS Number	101328-85-2
Catalog Number	AG00048G(AGN-PC-0NV6B6)
Chemical Name	3(2H)-Pyridazinone, 6-(4-aminophenyl)-4,5-dihydro-5-methyl-, (5R)-
IUPAC Name	(4R)-3-(4-aminophenyl)-4-methyl-4,5-dihydro-1H-pyridazin-6-one
InChI	InChI=1S/C11H13N3O/c1-7-6-10(15)13-14-11(7)8-2-4-9(12)5-3-8/h2-5,7H,6,12H2,1H3,(H,13,15)/t7-/m1/s1
InChI Key	GDMRFHZLKNYRRO-SSDOTTSWSA-N
MDL Number	MFCD09032921
Molecular Formula	C11H13N3O
Molecular Weight	203.2404
SMILES	C[C@H]1C(=NNC(=O)C1)c1ccc(cc1)N
Synonyms	((4-(1,4,5,6-tetrahydro-4-methyl-6-oxo-3-pyridazinyl)phenyl)hydrazono)propanedinitrile, dextrosimendan, Levosimendan, OR 1259, OR 1855, OR-1259, OR-1855, Simadax, simendan, 101328-85-2, (R)-6-(4-Aminophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one, OR-1855, (r)-6-(4-aminophenyl)-4,5-dihydro-5-methyl-3(2h)-pyridazinone, OR 1855, (R)-6-(4-Aminophenyl)-5-Methylpyridazin-3(2H)One, 3(2H)-Pyridazinone, 6-(4-aminophenyl)-4,5-dihydro-5-methyl-, (R)-, (4R)-3-(4-Aminophenyl)-4-methyl-4,5-dihydro-1H-pyridazin-6-one, GDMRFHZLKNYRRO-SSDOTTSWSA-N, OR1855, SCHEMBL5681256, 3(2H)-Pyridazinone,6-(4-aminophenyl)-4,5-dihydro-5-methyl-, (5R)-, CTK3J9693, ZINC5141586, AC-070, BBL102299, CA-590, MFCD09032921, STL556098, AKOS015889656, AJ-53322, BC218833, CJ-12466, DS-15085, AB0070440, RT-005676, ST2408178, TL8000087, CS-0031338, FT-0600355, 328A852, J-000368, BRD-K79723649-001-01-3, 6-(4-Aminophenyl)-4,5-dihydro-5-mehtyl-3(2H)-pyridazinone, (5R)-6-(4-Aminophenyl)-4,5-dihydro-5-methyl-3(2H)-pyridazinone, (5R)-6-(4-aminophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one, (R)-6-(4-aminophenyl)-5-methyl-4 5-dihydro-3(2H)-pyridazinone, (R)-6-(4-aminophenyl)-5-methyl-4,5-dihydro-2H-pyridazin-3-one, (R)-6-(4-aminophenyl)-5-methyl-4,5-dihydro-3(2H)-pyridazinone, 3(2H)-Pyridazinone, 6-(4-aminophenyl)-4,5-dihydro-5-methyl-, (5R)-, CID10465484, UR6330000,

Complexity	280
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	203.106g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	203.245g/mol
Monoisotopic Mass	203.106g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	67.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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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