Bromosporine, 99.69%

Name: Bromosporine
Brand: Chempure

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CAS Number

1619994-69-2

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IUPAC name	ethyl N-[6-[3-(methanesulfonamido)-4-methylphenyl]-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]carbamate
inchi	InChI=1S/C17H20N6O4S/c1-5-27-17(24)18-15-9-14(21-23-11(3)19-20-16(15)23)12-7-6-10(2)13(8-12)22-28(4,25)26/h6-9,22H,5H2,1-4H3,(H,18,24)
inchi key	UYBRROMMFMPJAN-UHFFFAOYSA-N
molecular formula	C17H20N6O4S
synonyms	Bromosporine 1619994-69-2 ethyl (3-methyl-6-(4-methyl-3-(methylsulfonamido)phenyl)-[1,2,4]triazolo[4,3-b]pyridazin-8-yl)carbamate CHEMBL3133807 Carbamic acid, N-[3-methyl-6-[4-methyl-3-[(methylsulfonyl)amino]phenyl]-1,2,4-triazolo[4,3-b]pyridazin-8-yl]-, ethyl ester

Computed Properties

Molecular Weight:	404.4 g/mol
XLogP3:	1.1
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	8
Rotatable Bond Count:	6
Exact Mass:	404.12667431 g/mol
Monoisotopic Mass:	404.12667431 g/mol
Topological Polar Surface Area:	136 Å²
Heavy Atom Count:	28
Formal Charge:	0
Complexity:	657
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

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Product No: AS0191

Bromosporine, 99.69%

Product No: AS0191

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Product No: AS0191

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