4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide

C19H14N4O6S2 — CID 42610216

IUPAC4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide
SMILESNS(=O)(=O)c1ccccc1S(=O)(=O)NC(=O)c1ccc(-c2nc3cnccc3o2)cc1
InChIInChI=1S/C19H14N4O6S2/c20-30(25,26)16-3-1-2-4-17(16)31(27,28)23-18(24)12-5-7-13(8-6-12)19-22-14-11-21-10-9-15(14)29-19/h1-11H,(H,23,24)(H2,20,25,26)
InChIKeyOGZSAXPFKNNAKN-UHFFFAOYSA-N
MW458.48 g/mol
LogP1.66
Rot. Bonds5

About 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide

4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide (PubChem CID 42610216) has the molecular formula C19H14N4O6S2 and a molecular weight of 458.48 g/mol. Its IUPAC name is 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide.

Molecular Properties

Compound Name4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide
PubChem CID42610216
Molecular FormulaC19H14N4O6S2
Molecular Weight458.48 g/mol
Exact Mass458.04
IUPAC Name4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide
SMILESNS(=O)(=O)c1ccccc1S(=O)(=O)NC(=O)c1ccc(-c2nc3cnccc3o2)cc1
InChIInChI=1S/C19H14N4O6S2/c20-30(25,26)16-3-1-2-4-17(16)31(27,28)23-18(24)12-5-7-13(8-6-12)19-22-14-11-21-10-9-15(14)29-19/h1-11H,(H,23,24)(H2,20,25,26)
InChIKeyOGZSAXPFKNNAKN-UHFFFAOYSA-N
XLogP1.66
TPSA162.32 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.48
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide with MolForge

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Related Compounds

methyl 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)benzoate
CID 66864810
N-[3-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]-4-phenylbenzamide
CID 29130005
4-prop-1-en-2-yl-N-(2-sulfamoylphenyl)sulfonylbenzamide
CID 89187439
6-pyridin-2-yl-N-(2-sulfamoylphenyl)sulfonylpyridine-3-carboxamide
CID 71013158
5-bromo-N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide
CID 29127725
N-[4-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]furan-2-carboxamide
CID 39311457
N-[2-chloro-5-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]pyridine-3-carboxamide
CID 39349143
3,4-dimethoxy-N-[2-methoxy-5-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]benzamide
CID 39349570
2-bromo-N-[2-methoxy-5-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]benzamide
CID 39347163
4-(dimethylamino)-N-[3-([1,3]oxazolo[4,5-c]pyridin-2-yl)phenyl]benzamide;molecular hydrogen
CID 143408686
N-(2-aminosulfanylphenyl)sulfanyl-4-(1,3-benzoxazol-2-yl)benzamide
CID 143805962
N-[4-(1,3-benzoxazol-2-yl)phenyl]pyridine-3-carboxamide
CID 778969

Frequently Asked Questions

What is the IUPAC name of 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide?
The IUPAC name of 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide (CID 42610216) is 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide.
What is the SMILES notation for 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide?
The canonical SMILES for 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide is NS(=O)(=O)c1ccccc1S(=O)(=O)NC(=O)c1ccc(-c2nc3cnccc3o2)cc1.
What is the InChIKey of 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide?
The InChIKey is OGZSAXPFKNNAKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O6S2/c20-30(25,26)16-3-1-2-4-17(16)31(27,28)23-18(24)12-5-7-13(8-6-12)19-22-14-11-21-10-9-15(14)29-19/h1-11H,(H,23,24)(H2,20,25,26).
What are the key properties of 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide?
4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide has a molecular weight of 458.48 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-([1,3]oxazolo[4,5-c]pyridin-2-yl)-N-(2-sulfamoylphenyl)sulfonylbenzamide is sourced from PubChem (CID 42610216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).