N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide

C14H25N3O3S2Si — CID 23449146

IUPACN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide
SMILESCN(CCO[Si](C)(C)C(C)(C)C)S(=O)(=O)c1ncn2ccsc12
InChIInChI=1S/C14H25N3O3S2Si/c1-14(2,3)23(5,6)20-9-7-16(4)22(18,19)12-13-17(11-15-12)8-10-21-13/h8,10-11H,7,9H2,1-6H3
InChIKeyABRYCZRTDACASH-UHFFFAOYSA-N
MW375.59 g/mol
LogP3.04
Rot. Bonds6

About N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide

N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide (PubChem CID 23449146) has the molecular formula C14H25N3O3S2Si and a molecular weight of 375.59 g/mol. Its IUPAC name is N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide.

Molecular Properties

Compound NameN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide
PubChem CID23449146
Molecular FormulaC14H25N3O3S2Si
Molecular Weight375.59 g/mol
Exact Mass375.11
IUPAC NameN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide
SMILESCN(CCO[Si](C)(C)C(C)(C)C)S(=O)(=O)c1ncn2ccsc12
InChIInChI=1S/C14H25N3O3S2Si/c1-14(2,3)23(5,6)20-9-7-16(4)22(18,19)12-13-17(11-15-12)8-10-21-13/h8,10-11H,7,9H2,1-6H3
InChIKeyABRYCZRTDACASH-UHFFFAOYSA-N
XLogP3.04
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.59
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
The IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide (CID 23449146) is N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide.
What is the SMILES notation for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
The canonical SMILES for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide is CN(CCO[Si](C)(C)C(C)(C)C)S(=O)(=O)c1ncn2ccsc12.
What is the InChIKey of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
The InChIKey is ABRYCZRTDACASH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3S2Si/c1-14(2,3)23(5,6)20-9-7-16(4)22(18,19)12-13-17(11-15-12)8-10-21-13/h8,10-11H,7,9H2,1-6H3.
What are the key properties of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide?
N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide has a molecular weight of 375.59 g/mol, XLogP of 3.04, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-methylimidazo[5,1-b][1,3]thiazole-7-sulfonamide is sourced from PubChem (CID 23449146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).