N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide

C5H5N5O2S2 — CID 114913591

IUPACN-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide
SMILESO=S(=O)(Nc1cnns1)c1cnc[nH]1
InChIInChI=1S/C5H5N5O2S2/c11-14(12,5-2-6-3-7-5)9-4-1-8-10-13-4/h1-3,9H,(H,6,7)
InChIKeyLXWWFWGUSCFYBP-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.06
Rot. Bonds3

About N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide

N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide (PubChem CID 114913591) has the molecular formula C5H5N5O2S2 and a molecular weight of 231.26 g/mol. Its IUPAC name is N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide
PubChem CID114913591
Molecular FormulaC5H5N5O2S2
Molecular Weight231.26 g/mol
Exact Mass230.99
IUPAC NameN-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide
SMILESO=S(=O)(Nc1cnns1)c1cnc[nH]1
InChIInChI=1S/C5H5N5O2S2/c11-14(12,5-2-6-3-7-5)9-4-1-8-10-13-4/h1-3,9H,(H,6,7)
InChIKeyLXWWFWGUSCFYBP-UHFFFAOYSA-N
XLogP0.06
TPSA100.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N-(thiadiazol-5-yl)-1H-pyrazole-4-sulfonamide
CID 114911708
N-(thiadiazol-5-yl)ethanesulfonamide
CID 107649055
N-(3-amino-6-fluoro-2-methylphenyl)-1H-imidazole-5-sulfonamide
CID 114244719
N-(3-methylphenyl)-1H-imidazole-5-sulfonamide
CID 3658049
N-(3-amino-4-bromophenyl)-1H-imidazole-5-sulfonamide
CID 79768373
N-(5,6-diethyl-1,2,4-triazin-3-yl)-1H-imidazole-5-sulfonamide
CID 114388862
5-(thiadiazol-5-ylsulfamoyl)thiophene-3-carboxylic acid
CID 114911893
3-amino-4-methyl-N-(thiadiazol-5-yl)benzenesulfonamide
CID 114911645
5-(1H-imidazol-5-ylsulfonylamino)-1H-pyrazole-4-carbothioamide
CID 79500168
N-[4-(2-chloroethyl)phenyl]-1H-imidazole-5-sulfonamide
CID 65031162
N-[2-(bromomethyl)phenyl]-1H-imidazole-5-sulfonamide
CID 114296143
N-(4-bromocyclohexyl)-1H-imidazole-5-sulfonamide
CID 114295890

Frequently Asked Questions

What is the IUPAC name of N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide (CID 114913591) is N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide is O=S(=O)(Nc1cnns1)c1cnc[nH]1.
What is the InChIKey of N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide?
The InChIKey is LXWWFWGUSCFYBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N5O2S2/c11-14(12,5-2-6-3-7-5)9-4-1-8-10-13-4/h1-3,9H,(H,6,7).
What are the key properties of N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide?
N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide has a molecular weight of 231.26 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiadiazol-5-yl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 114913591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).