N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide

C19H16N4O3S — CID 25034963

IUPACN-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide
SMILESCn1nccc1NS(=O)(=O)c1nc(-c2ccccc2)oc1-c1ccccc1
InChIInChI=1S/C19H16N4O3S/c1-23-16(12-13-20-23)22-27(24,25)19-17(14-8-4-2-5-9-14)26-18(21-19)15-10-6-3-7-11-15/h2-13,22H,1H3
InChIKeyQPZSHFAJYMHXSR-UHFFFAOYSA-N
MW380.43 g/mol
LogP3.54
Rot. Bonds5

About N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide

N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide (PubChem CID 25034963) has the molecular formula C19H16N4O3S and a molecular weight of 380.43 g/mol. Its IUPAC name is N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide
PubChem CID25034963
Molecular FormulaC19H16N4O3S
Molecular Weight380.43 g/mol
Exact Mass380.09
IUPAC NameN-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide
SMILESCn1nccc1NS(=O)(=O)c1nc(-c2ccccc2)oc1-c1ccccc1
InChIInChI=1S/C19H16N4O3S/c1-23-16(12-13-20-23)22-27(24,25)19-17(14-8-4-2-5-9-14)26-18(21-19)15-10-6-3-7-11-15/h2-13,22H,1H3
InChIKeyQPZSHFAJYMHXSR-UHFFFAOYSA-N
XLogP3.54
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.43
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
The IUPAC name of N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide (CID 25034963) is N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide.
What is the SMILES notation for N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
The canonical SMILES for N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide is Cn1nccc1NS(=O)(=O)c1nc(-c2ccccc2)oc1-c1ccccc1.
What is the InChIKey of N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
The InChIKey is QPZSHFAJYMHXSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3S/c1-23-16(12-13-20-23)22-27(24,25)19-17(14-8-4-2-5-9-14)26-18(21-19)15-10-6-3-7-11-15/h2-13,22H,1H3.
What are the key properties of N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide?
N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide has a molecular weight of 380.43 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpyrazol-3-yl)-2,5-diphenyl-1,3-oxazole-4-sulfonamide is sourced from PubChem (CID 25034963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).