N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide

C19H16N4O3S — CID 25041879

IUPACN-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)n[nH]1
InChIInChI=1S/C19H16N4O3S/c1-13-12-16(22-21-13)23-27(24,25)19-17(14-8-4-2-5-9-14)26-18(20-19)15-10-6-3-7-11-15/h2-12H,1H3,(H2,21,22,23)
InChIKeyNCSSQEBTFNQEHE-UHFFFAOYSA-N
MW380.43 g/mol
LogP3.84
Rot. Bonds5

About N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide

N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide (PubChem CID 25041879) has the molecular formula C19H16N4O3S and a molecular weight of 380.43 g/mol. Its IUPAC name is N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide.

Molecular Properties

Compound NameN-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide
PubChem CID25041879
Molecular FormulaC19H16N4O3S
Molecular Weight380.43 g/mol
Exact Mass380.09
IUPAC NameN-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)n[nH]1
InChIInChI=1S/C19H16N4O3S/c1-13-12-16(22-21-13)23-27(24,25)19-17(14-8-4-2-5-9-14)26-18(20-19)15-10-6-3-7-11-15/h2-12H,1H3,(H2,21,22,23)
InChIKeyNCSSQEBTFNQEHE-UHFFFAOYSA-N
XLogP3.84
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.43
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
The IUPAC name of N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide (CID 25041879) is N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide.
What is the SMILES notation for N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
The canonical SMILES for N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide is Cc1cc(NS(=O)(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)n[nH]1.
What is the InChIKey of N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
The InChIKey is NCSSQEBTFNQEHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3S/c1-13-12-16(22-21-13)23-27(24,25)19-17(14-8-4-2-5-9-14)26-18(20-19)15-10-6-3-7-11-15/h2-12H,1H3,(H2,21,22,23).
What are the key properties of N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide has a molecular weight of 380.43 g/mol, XLogP of 3.84, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-pyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide is sourced from PubChem (CID 25041879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).