Ametryn Nitroso Impurity 1

CAT: 1299-RG-E242655-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-E242655-01Size:10 mg

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CAS Number

2731965-10-7

Synonyms

N-ethyl-N- (4- (isopropylamino) -6- (methylthio) -1,3,5-triazin-2-yl) nitrous amide

Molecular Formula

C9H16N6OS

Molecular Weight

256.33

Target Alternative Name

Ametryn

Chemical Information

1,4-Dihydro-1,3,5-triazine

CAS Number	2731965-10-7
PubChem CID	15184872
IUPAC Name	1,4-dihydro-1,3,5-triazine
Molecular Formula	C3H5N3
Molecular Weight	83.09
XLogP	-0.8
Topological Polar Surface Area	36.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	6
Formal Charge	0
Complexity	74

SMILES

C1N=CNC=N1

InChI

InChI=1S/C3H5N3/c1-4-2-6-3-5-1/h1-2H,3H2,(H,4,5,6)

InChIKey

RMQOXNXLVICLNK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2731965-10-7

CID: 15184872

Formula: C3H5N3

MW: 83.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	83.09
XLogP3	-0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	83.048347172
Monoisotopic Mass	83.048347172
Topological Polar Surface Area	36.8 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	74
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
RG-A260938-01	Ametryn
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RM-C192049-01	Candesartan Nitroso Impurity 1
RM-Z091404-01	Zinc Acexamate Nitroso Impurity 1
RM-A165157-01	Azithromycin Nitroso Impurity 57 (N-Nitroso Azithromycin EP Impurity M)
RM-H032055-01	Hydrochlorothiazide Nitroso Impurity 55
RM-T181975-01	Torasemide Nitroso Impurity 75
RM-T181974-01	Torasemide Nitroso Impurity 74
RM-C013431-01	Cariprazine Nitroso Impurity 31
RM-R160778-01	Repaglinide Nitroso Impurity 52

Catalog	Name
TRC-N494005-250MG	N-Nitroso Ametryn
AR-A06131-01	Ametryn Impurity 4
AR-A06129-01	Ametryn Impurity 6
AR-A06124-01	Ametryn Impurity 5 (Sebuthylazine-2-hydroxy)
CS-O-41480	Vardenafil Nitroso Impurity
CS-EO-01989	Tofacitinib Nitroso Impurity
CS-O-46598	Midazolam Nitroso Impurity
CS-EO-01654	Encorafenib Nitroso Impurity
CS-EO-01535-10MG	Elagolix Nitroso Impurity
CS-O-59322	Ilaprazole Nitroso Impurity