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  2. 2-Benzothiazolamine, N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-,(2Z)-2-butenedioate (1:2)

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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

2-Benzothiazolamine, N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-,(2Z)-2-butenedioate (1:2)

C1CCN(CC1)Cc1cccc(c1)OCCCNc1nc2c(s1)cccc2.OC(=O)C=CC(=O)O.OC(=O)C=CC(=O)O Request for Quotation
Chemical Name: 2-Benzothiazolamine, N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-,(2Z)-2-butenedioate (1:2)
CAS Number: 104076-39-3
Product Number: AG007F1Z(AGN-PC-0OSUEU)
Synonyms:
MDL No: MFCD01862676
Molecular Formula: C30H35N3O9S
Molecular Weight: 613.6786

Identification/Properties

Computed Properties
Molecular Weight:
613.682g/mol
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
12
Exact Mass:
613.209g/mol
Monoisotopic Mass:
613.209g/mol
Topological Polar Surface Area:
215A^2
Heavy Atom Count:
43
Formal Charge:
0
Complexity:
551
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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