4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver

C22H24AgN8O6S2 — CID 118386705

IUPAC4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver
SMILESCOc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1.Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1.[Ag]
InChIInChI=1S/C12H14N4O4S.C10H10N4O2S.Ag/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9;11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10;/h3-7H,13H2,1-2H3,(H,14,15,16);1-7H,11H2,(H,12,13,14);
InChIKeyFNUMYVJNIIZRDH-UHFFFAOYSA-N
MW668.49 g/mol
LogP1.73
Rot. Bonds8

About 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver

4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver (PubChem CID 118386705) has the molecular formula C22H24AgN8O6S2 and a molecular weight of 668.49 g/mol. Its IUPAC name is 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver.

Molecular Properties

Compound Name4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver
PubChem CID118386705
Molecular FormulaC22H24AgN8O6S2
Molecular Weight668.49 g/mol
Exact Mass667.03
IUPAC Name4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver
SMILESCOc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1.Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1.[Ag]
InChIInChI=1S/C12H14N4O4S.C10H10N4O2S.Ag/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9;11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10;/h3-7H,13H2,1-2H3,(H,14,15,16);1-7H,11H2,(H,12,13,14);
InChIKeyFNUMYVJNIIZRDH-UHFFFAOYSA-N
XLogP1.73
TPSA214.40 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds8
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500668.49
LogP ≤ 51.73
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Launch Full Analysis

Related Compounds

silver 4-amino-N-pyrimidin-2-ylbenzenesulfonamide
CID 6711387
bis(4-amino-N-pyrimidin-2-ylbenzenesulfonamide) dichloride
CID 18407969
N-(2,6-dimethoxypyrimidin-4-yl)-4-(ethylsulfonylamino)benzenesulfonamide
CID 22203987
N-(2,6-dimethoxypyrimidin-4-yl)-4-[(3-methyl-1,4-dioxonaphthalen-2-yl)amino]benzenesulfonamide
CID 58398247
N-(2,6-dimethoxypyrimidin-4-yl)-4-(2,5-dioxopyrrol-1-yl)benzenesulfonamide
CID 1116833
N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]benzamide
CID 1076758
1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-pyridin-4-ylthiourea
CID 134129947
2,6-dichloro-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]benzamide
CID 1322982
N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-2,2-dimethylpropanamide
CID 1040326
N-(2,6-dimethoxypyrimidin-4-yl)-4-[(4-methylphthalazin-1-yl)amino]benzenesulfonamide
CID 25041756
4-aminobenzenesulfonamide;4-amino-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide
CID 174885435
trisodium;1-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]-N-(1-sulfoethyl)anilino]ethanesulfonic acid
CID 121232505

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver?
The IUPAC name of 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver (CID 118386705) is 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver.
What is the SMILES notation for 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver?
The canonical SMILES for 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver is COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1.Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1.[Ag].
What is the InChIKey of 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver?
The InChIKey is FNUMYVJNIIZRDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O4S.C10H10N4O2S.Ag/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9;11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10;/h3-7H,13H2,1-2H3,(H,14,15,16);1-7H,11H2,(H,12,13,14);.
What are the key properties of 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver?
4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver has a molecular weight of 668.49 g/mol, XLogP of 1.73, 8 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,6-dimethoxypyrimidin-4-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide;silver is sourced from PubChem (CID 118386705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).