N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide

C24H21N3O4S — CID 1316979

IUPACN-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide
SMILESCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(c3ccccc3)c3ccccc3)cc2)no1
InChIInChI=1S/C24H21N3O4S/c1-17-16-22(26-31-17)27-32(29,30)21-14-12-20(13-15-21)25-24(28)23(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-16,23H,1H3,(H,25,28)(H,26,27)
InChIKeyKAXSZNSJHDZAKV-UHFFFAOYSA-N
MW447.52 g/mol
LogP4.55
Rot. Bonds7

About N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide

N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide (PubChem CID 1316979) has the molecular formula C24H21N3O4S and a molecular weight of 447.52 g/mol. Its IUPAC name is N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide
PubChem CID1316979
Molecular FormulaC24H21N3O4S
Molecular Weight447.52 g/mol
Exact Mass447.13
IUPAC NameN-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide
SMILESCc1cc(NS(=O)(=O)c2ccc(NC(=O)C(c3ccccc3)c3ccccc3)cc2)no1
InChIInChI=1S/C24H21N3O4S/c1-17-16-22(26-31-17)27-32(29,30)21-14-12-20(13-15-21)25-24(28)23(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-16,23H,1H3,(H,25,28)(H,26,27)
InChIKeyKAXSZNSJHDZAKV-UHFFFAOYSA-N
XLogP4.55
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.52
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide?
The IUPAC name of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide (CID 1316979) is N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide is Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C(c3ccccc3)c3ccccc3)cc2)no1.
What is the InChIKey of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide?
The InChIKey is KAXSZNSJHDZAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O4S/c1-17-16-22(26-31-17)27-32(29,30)21-14-12-20(13-15-21)25-24(28)23(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-16,23H,1H3,(H,25,28)(H,26,27).
What are the key properties of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide?
N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide has a molecular weight of 447.52 g/mol, XLogP of 4.55, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2,2-diphenylacetamide is sourced from PubChem (CID 1316979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).