AG000JSE

1229236-83-2 | (4-Chloro-2-fluorophenyl)(6-chloro-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazin-3-yl)methanone

AG000JSE

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CAS Number	1229236-83-2
Catalog Number	AG000JSE(AGN-PC-0WAMW8)
Chemical Name	(4-Chloro-2-fluorophenyl)(6-chloro-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazin-3-yl)methanone
IUPAC Name	(4-chloro-2-fluorophenyl)-[6-chloro-2-methyl-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-3-yl]methanone
InChI	InChI=1S/C19H17Cl2FN4O2/c1-11-17(18(27)14-3-2-13(20)9-15(14)22)26-19(23-11)12(8-16(21)24-26)10-25-4-6-28-7-5-25/h2-3,8-9H,4-7,10H2,1H3
InChI Key	WXZUHCAKLKTCGB-UHFFFAOYSA-N
MDL Number	MFCD23135464
Molecular Formula	C19H17Cl2FN4O2
Molecular Weight	423.2683
SMILES	CC1=C(N2N=C(Cl)C=C(CN3CCOCC3)C2=N1)C(=O)C1=CC=C(Cl)C=C1F
Synonyms	1229236-83-2, (4-Chloro-2-fluorophenyl)(6-chloro-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazin-3-yl)methanone, (4-chloro-2-fluorophenyl)(6-chloro-2-methyl-8-(morpholinomethyl)-imidazo[1,2-b]pyridazin-3-yl)methanone, AK102352, WXZUHCAKLKTCGB-UHFFFAOYSA-N, SCHEMBL2511766, CTK8B9206, DTXSID70718948, KS-00000Q8I, 4423AA, ANW-62204, MFCD23135464, ZINC79069559, AKOS016005556, DS-3816, SY060733, AJ-123107, AX8233891, TC-150949, MFCD23135464 (95%), (4-chloro-2-fluorophenyl)-[6-chloro-2-methyl-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-3-yl]methanone, (4-Chloro-2-fluorophenyl){6-chloro-2-methyl-8-[(morpholin-4-yl)methyl]imidazo[1,2-b]pyridazin-3-yl}methanone, 3-[(4-Chloro-2-fluorophenyl)(oxo)methyl]-6-chloro-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazine, 6-Chloro-3-(4-chloro-2-fluorobenzoyl)-2-methyl-8-(morpholinomethyl)imidazo[1,2-b]pyridazine, Methanone, (4-chloro-2-fluorophenyl)[6-chloro-2-methyl-8-(4-morpholinylmethyl)imidazo[1,2-b]pyridazin-3-yl]-, C19H17Cl2FN4O2,

Complexity	568
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	422.071g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	423.269g/mol
Monoisotopic Mass	422.071g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	59.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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