Sulfadiazine Silver

Synopsis, Chemistry

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Also known as: Akos015967004

Molecular Formula

C₁₀H₁₂AgN₄O₂S+₃

Molecular Weight

360.16 g/mol

InChI Key

GOYDASFKHSBSBH-UHFFFAOYSA-P

1 2D Structure

Sulfadiazine Silver

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

silver;[(4-aminophenyl)-oxo-oxoniumylidene-6-sulfanyl]-pyrimidin-2-ylazanium

2.1.2 InChI

InChI=1S/C10H10N4O2S.Ag/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10;/h1-7H,11H2,(H,12,13,14,15,16);/q;+1/p+2

2.1.3 InChI Key

GOYDASFKHSBSBH-UHFFFAOYSA-P

2.1.4 Canonical SMILES

C1=CN=C(N=C1)[NH2+]S(=[OH+])(=O)C2=CC=C(C=C2)N.[Ag+]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Akos015967004

2.3 Create Date

2009-03-31

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₂AgN₄O₂S+₃
Molecular Weight	360.16 g/mol
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	358.97319 g/mol
Monoisotopic Mass	358.97319 g/mol
Topological Polar Surface Area	94.9 Å²
Heavy Atom Count	18
Formal Charge	3
Complexity	342
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