Orazamide

CAT: 0926-FO65114-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0926-FO65114-01Size:5 g

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CAS Number

2574-78-9

MDL Number

MFCD06411016

Smiles

NC (=O) c1[nH]cnc1N.OC (=O) C2=CC (=O) NC (=O) N2

Molecular Formula

C5H4N2O4•C4H6N4O

Molecular Weight

282.21 g/mol

Controlled

Chemical Information

Orazamide

RN given refers to parent cpd

CAS Number	2574-78-9
PubChem CID	167459
IUPAC Name	4-amino-1H-imidazole-5-carboxamide;2,4-dioxo-1H-pyrimidine-6-carboxylic acid
Molecular Formula	C9H10N6O5
Molecular Weight	282.21
Topological Polar Surface Area	193
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Heavy Atom Count	20
Formal Charge	0
Complexity	393

SMILES

C1=C(NC(=O)NC1=O)C(=O)O.C1=NC(=C(N1)C(=O)N)N

InChI

InChI=1S/C5H4N2O4.C4H6N4O/c8-3-1-2(4(9)10)6-5(11)7-3;5-3-2(4(6)9)7-1-8-3/h1H,(H,9,10)(H2,6,7,8,11);1H,5H2,(H2,6,9)(H,7,8)

InChIKey

PVCSUEOGEIOUHG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2574-78-9

CID: 167459

Formula: C9H10N6O5

MW: 282.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	282.21
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	282.07126744
Monoisotopic Mass	282.07126744
Topological Polar Surface Area	193 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	393
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	2
Compound Is Canonicalized	Yes