LSD1-IN-6 10mg

CAT: 0628-A20474-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A20474-10Size:10 mg

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CAS Number

2035912-43-5

Chemical Information

Lsd1-IN-6

CAS Number	2035912-43-5
PubChem CID	137639487
IUPAC Name	4-[(E)-2-(2-bromo-4,5-dihydroxyphenyl)ethenyl]-N'-hydroxybenzenecarboximidamide
Molecular Formula	C15H13BrN2O3
Molecular Weight	349.18
XLogP	3.3
Topological Polar Surface Area	99.1
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	21
Formal Charge	0
Complexity	394

SMILES

C1=CC(=CC=C1/C=C/C2=CC(=C(C=C2Br)O)O)/C(=N/O)/N

InChI

InChI=1S/C15H13BrN2O3/c16-12-8-14(20)13(19)7-11(12)6-3-9-1-4-10(5-2-9)15(17)18-21/h1-8,19-21H,(H2,17,18)/b6-3+

InChIKey

JDEDYOAMPIVKCF-ZZXKWVIFSA-N

Chemical Structure

2D Structure

CAS: 2035912-43-5

CID: 137639487

Formula: C15H13BrN2O3

MW: 349.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	349.18
XLogP3	3.3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	348.01095
Monoisotopic Mass	348.01095
Topological Polar Surface Area	99.1 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	394
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	1
Compound Is Canonicalized	Yes

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