IDO-IN-3 50mg

CAT: 0628-A20898-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A20898-50Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

2070018-30-1

Chemical Information

Ido-IN-3

CAS Number	2070018-30-1
PubChem CID	136898218
IUPAC Name	4-(2-aminoethylamino)-N'-(3-bromo-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamide
Molecular Formula	C11H12BrFN6O2
Molecular Weight	359.15
XLogP	1.4
Topological Polar Surface Area	122
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	6
Heavy Atom Count	21
Formal Charge	0
Complexity	364

SMILES

C1=CC(=C(C=C1N=C(C2=NON=C2NCCN)NO)Br)F

InChI

InChI=1S/C11H12BrFN6O2/c12-7-5-6(1-2-8(7)13)16-11(17-20)9-10(15-4-3-14)19-21-18-9/h1-2,5,20H,3-4,14H2,(H,15,19)(H,16,17)

InChIKey

DAPNMIADTFAXEG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2070018-30-1

CID: 136898218

Formula: C11H12BrFN6O2

MW: 359.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	359.15
XLogP3	1.4
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	6
Exact Mass	358.01891
Monoisotopic Mass	358.01891
Topological Polar Surface Area	122 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	364
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

Catalog	Name
HI9371103	Total Chlorine Reagent 0-3.50mg L
IBCTCLS3TFT50MG	Bacteria-Derived Collagenase Type 3 Purified filtered 50mg
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E8ER1706-94	IDO
YP-W101352-01	Monkey IDO (IDO) ELISA Kit
YP-W16543-01	Human IDO (IDO) ELISA Kit
053158	IDO (Indoleamine-2,3-Dioxygenase)
BA7836-5.1	IDO-IN-12
C3211-5	IDO-IN-1
B8310-100	IDO-IN-2