2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide

C23H20N4O5S — CID 25437116

IUPAC2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
SMILESCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)c1
InChIInChI=1S/C23H20N4O5S/c1-26(17-9-3-2-4-10-17)33(31,32)18-11-7-8-16(14-18)24-21(28)15-27-20-13-6-5-12-19(20)22(29)25-23(27)30/h2-14H,15H2,1H3,(H,24,28)(H,25,29,30)
InChIKeySWPCFIHLRTWYNN-UHFFFAOYSA-N
MW464.50 g/mol
LogP2.15
Rot. Bonds6

About 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide

2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide (PubChem CID 25437116) has the molecular formula C23H20N4O5S and a molecular weight of 464.50 g/mol. Its IUPAC name is 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
PubChem CID25437116
Molecular FormulaC23H20N4O5S
Molecular Weight464.50 g/mol
Exact Mass464.12
IUPAC Name2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
SMILESCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)c1
InChIInChI=1S/C23H20N4O5S/c1-26(17-9-3-2-4-10-17)33(31,32)18-11-7-8-16(14-18)24-21(28)15-27-20-13-6-5-12-19(20)22(29)25-23(27)30/h2-14H,15H2,1H3,(H,24,28)(H,25,29,30)
InChIKeySWPCFIHLRTWYNN-UHFFFAOYSA-N
XLogP2.15
TPSA121.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.50
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-methyl-2-oxo-1-pyridinyl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 56510143
2-(3,6-dioxo-1H-pyridazin-2-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 9467923
2-(N-methylanilino)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 8689679
2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 55304420
2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 8930825
3-(2,5-dioxopyrrolidin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]propanamide
CID 29358158
2-[(4R)-4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 41144468
[2-[3-[methyl(phenyl)sulfamoyl]anilino]-2-oxoethyl] propanoate
CID 7851108
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 16582070
2-(4-fluorophenoxy)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 42989226
2-methyl-N-[3-[methyl(phenyl)sulfamoyl]phenyl]-1H-indole-3-carboxamide
CID 26739273
N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 4880016

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide (CID 25437116) is 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide is CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)c1.
What is the InChIKey of 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is SWPCFIHLRTWYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O5S/c1-26(17-9-3-2-4-10-17)33(31,32)18-11-7-8-16(14-18)24-21(28)15-27-20-13-6-5-12-19(20)22(29)25-23(27)30/h2-14H,15H2,1H3,(H,24,28)(H,25,29,30).
What are the key properties of 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide?
2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 464.50 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxoquinazolin-1-yl)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 25437116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).