N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide

C11H9N5O2S2 — CID 121135238

IUPACN-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(-n2ccnc2)ncn1)c1cccs1
InChIInChI=1S/C11H9N5O2S2/c17-20(18,11-2-1-5-19-11)15-9-6-10(14-7-13-9)16-4-3-12-8-16/h1-8H,(H,13,14,15)
InChIKeySYXSRZVPVFBVPH-UHFFFAOYSA-N
MW307.36 g/mol
LogP1.52
Rot. Bonds4

About N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide

N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide (PubChem CID 121135238) has the molecular formula C11H9N5O2S2 and a molecular weight of 307.36 g/mol. Its IUPAC name is N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide
PubChem CID121135238
Molecular FormulaC11H9N5O2S2
Molecular Weight307.36 g/mol
Exact Mass307.02
IUPAC NameN-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(-n2ccnc2)ncn1)c1cccs1
InChIInChI=1S/C11H9N5O2S2/c17-20(18,11-2-1-5-19-11)15-9-6-10(14-7-13-9)16-4-3-12-8-16/h1-8H,(H,13,14,15)
InChIKeySYXSRZVPVFBVPH-UHFFFAOYSA-N
XLogP1.52
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(6-imidazol-1-ylpyrimidin-4-yl)-2,4-dimethoxybenzenesulfonamide
CID 121135249
N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55829891
6-imidazol-1-yl-N-thiophen-2-ylsulfonylpyridine-2-carboxamide
CID 75524742
N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide
CID 17378925
2,5-dichloro-N-[4-[(6-imidazol-1-ylpyrimidin-4-yl)amino]phenyl]benzenesulfonamide
CID 121074115
N-(5-bromo-2-pyridinyl)thiophene-2-sulfonamide
CID 778331
N-[2-[(6-piperidin-1-ylpyrimidin-4-yl)amino]ethyl]thiophene-2-sulfonamide
CID 133397420
N-[5-(3,4-dimethylanilino)-2-pyridinyl]thiophene-2-sulfonamide
CID 113032152
N-[5-(4-chloroanilino)-2-pyridinyl]thiophene-2-sulfonamide
CID 113033430
(E)-1-[4-(6-imidazol-1-ylpyrimidin-4-yl)piperazin-1-yl]-3-thiophen-2-ylprop-2-en-1-one
CID 122338212
2-bromo-N-[4-(6-imidazol-1-ylpyrimidin-4-yl)oxyphenyl]benzenesulfonamide
CID 122312181
N-(6-pyrazol-1-ylpyrimidin-4-yl)pyridine-3-sulfonamide
CID 121135032

Frequently Asked Questions

What is the IUPAC name of N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide (CID 121135238) is N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide is O=S(=O)(Nc1cc(-n2ccnc2)ncn1)c1cccs1.
What is the InChIKey of N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide?
The InChIKey is SYXSRZVPVFBVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O2S2/c17-20(18,11-2-1-5-19-11)15-9-6-10(14-7-13-9)16-4-3-12-8-16/h1-8H,(H,13,14,15).
What are the key properties of N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide?
N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide has a molecular weight of 307.36 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 121135238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).