N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide

C19H15N5O3S2 — CID 55829891

IUPACN-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide
SMILESO=C(Nc1ccc(-n2ccnc2)nc1)c1cccc(NS(=O)(=O)c2cccs2)c1
InChIInChI=1S/C19H15N5O3S2/c25-19(22-16-6-7-17(21-12-16)24-9-8-20-13-24)14-3-1-4-15(11-14)23-29(26,27)18-5-2-10-28-18/h1-13,23H,(H,22,25)
InChIKeyWHOIZLQQPACRGO-UHFFFAOYSA-N
MW425.50 g/mol
LogP3.38
Rot. Bonds6

About N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide

N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide (PubChem CID 55829891) has the molecular formula C19H15N5O3S2 and a molecular weight of 425.50 g/mol. Its IUPAC name is N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide.

Molecular Properties

Compound NameN-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide
PubChem CID55829891
Molecular FormulaC19H15N5O3S2
Molecular Weight425.50 g/mol
Exact Mass425.06
IUPAC NameN-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide
SMILESO=C(Nc1ccc(-n2ccnc2)nc1)c1cccc(NS(=O)(=O)c2cccs2)c1
InChIInChI=1S/C19H15N5O3S2/c25-19(22-16-6-7-17(21-12-16)24-9-8-20-13-24)14-3-1-4-15(11-14)23-29(26,27)18-5-2-10-28-18/h1-13,23H,(H,22,25)
InChIKeyWHOIZLQQPACRGO-UHFFFAOYSA-N
XLogP3.38
TPSA105.98 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.50
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[3-(1,3-thiazol-2-yl)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55991234
N-(6-imidazol-1-ylpyrimidin-4-yl)thiophene-2-sulfonamide
CID 121135238
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 46487765
6-imidazol-1-yl-N-thiophen-2-ylsulfonylpyridine-2-carboxamide
CID 75524742
N-(5-piperidin-1-yl-2-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 78899574
N-(2,3-dimethylphenyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55786528
N-(6-imidazol-1-yl-3-pyridinyl)-1H-pyrazole-4-carboxamide
CID 60965851
N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55793963
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 46492108
3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide
CID 78897587
N-[2-(2-methylpropoxy)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55989925
N-(2-fluoro-4-methylphenyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55914376

Frequently Asked Questions

What is the IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide?
The IUPAC name of N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide (CID 55829891) is N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide.
What is the SMILES notation for N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide?
The canonical SMILES for N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide is O=C(Nc1ccc(-n2ccnc2)nc1)c1cccc(NS(=O)(=O)c2cccs2)c1.
What is the InChIKey of N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide?
The InChIKey is WHOIZLQQPACRGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O3S2/c25-19(22-16-6-7-17(21-12-16)24-9-8-20-13-24)14-3-1-4-15(11-14)23-29(26,27)18-5-2-10-28-18/h1-13,23H,(H,22,25).
What are the key properties of N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide?
N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide has a molecular weight of 425.50 g/mol, XLogP of 3.38, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-imidazol-1-yl-3-pyridinyl)-3-(thiophen-2-ylsulfonylamino)benzamide is sourced from PubChem (CID 55829891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).