N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide

C20H30N6O10S2Si2 — CID 88726914

IUPACN-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide
SMILESCO[Si](CCc1ccccc1S(=O)(=O)N=[N+]=[N-])(OC)OC.CO[Si](OC)(OC)c1ccc(S(=O)(=O)N=[N+]=[N-])cc1
InChIInChI=1S/C11H17N3O5SSi.C9H13N3O5SSi/c1-17-21(18-2,19-3)9-8-10-6-4-5-7-11(10)20(15,16)14-13-12;1-15-19(16-2,17-3)9-6-4-8(5-7-9)18(13,14)12-11-10/h4-7H,8-9H2,1-3H3;4-7H,1-3H3
InChIKeyGAHMPUCJMQILIZ-UHFFFAOYSA-N
MW634.80 g/mol
LogP2.88
Rot. Bonds14

About N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide

N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide (PubChem CID 88726914) has the molecular formula C20H30N6O10S2Si2 and a molecular weight of 634.80 g/mol. Its IUPAC name is N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide
PubChem CID88726914
Molecular FormulaC20H30N6O10S2Si2
Molecular Weight634.80 g/mol
Exact Mass634.10
IUPAC NameN-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide
SMILESCO[Si](CCc1ccccc1S(=O)(=O)N=[N+]=[N-])(OC)OC.CO[Si](OC)(OC)c1ccc(S(=O)(=O)N=[N+]=[N-])cc1
InChIInChI=1S/C11H17N3O5SSi.C9H13N3O5SSi/c1-17-21(18-2,19-3)9-8-10-6-4-5-7-11(10)20(15,16)14-13-12;1-15-19(16-2,17-3)9-6-4-8(5-7-9)18(13,14)12-11-10/h4-7H,8-9H2,1-3H3;4-7H,1-3H3
InChIKeyGAHMPUCJMQILIZ-UHFFFAOYSA-N
XLogP2.88
TPSA221.18 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds14
Heavy Atoms40
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500634.80
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

N-diazo-2-ethyl-3-trimethoxysilylbenzenesulfonamide
CID 18667836
N-diazo-4-methylbenzenesulfonamide
CID 13661
2-azido-N-diazobenzenesulfonamide
CID 57280224
N-diazo-4-(3-trihydroxysilylpropoxy)benzenesulfonamide
CID 89455528
N-diazo-4-(4-ethylphenoxy)benzenesulfonamide
CID 91323840
5-azidosulfonyl-2-methoxybenzamide
CID 43286593
(2,3,4,5,6-pentafluorophenyl) 4-azidosulfonylbenzoate
CID 77078459
2-(4-azidosulfonylphenoxy)acetic acid
CID 23039786
N-diazo-4-(5-oxo-4-phenyl-2H-furan-3-yl)benzenesulfonamide
CID 11473296
sodium 4-azidosulfonylbenzoate
CID 24767650
N-diazo-5-(dimethylamino)naphthalene-1-sulfonamide;4-(dimethylamino)-N-ethyl-N-methylnaphthalene-1-sulfonamide;propane
CID 157227352
2-[4-(benzenesulfonylmethyl)phenyl]ethyl-trimethoxysilane
CID 90226834

Frequently Asked Questions

What is the IUPAC name of N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide?
The IUPAC name of N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide (CID 88726914) is N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide.
What is the SMILES notation for N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide?
The canonical SMILES for N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide is CO[Si](CCc1ccccc1S(=O)(=O)N=[N+]=[N-])(OC)OC.CO[Si](OC)(OC)c1ccc(S(=O)(=O)N=[N+]=[N-])cc1.
What is the InChIKey of N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide?
The InChIKey is GAHMPUCJMQILIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O5SSi.C9H13N3O5SSi/c1-17-21(18-2,19-3)9-8-10-6-4-5-7-11(10)20(15,16)14-13-12;1-15-19(16-2,17-3)9-6-4-8(5-7-9)18(13,14)12-11-10/h4-7H,8-9H2,1-3H3;4-7H,1-3H3.
What are the key properties of N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide?
N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide has a molecular weight of 634.80 g/mol, XLogP of 2.88, 14 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-diazo-4-trimethoxysilylbenzenesulfonamide;N-diazo-2-(2-trimethoxysilylethyl)benzenesulfonamide is sourced from PubChem (CID 88726914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).