3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide

C19H18N4O6S — CID 75468512

IUPAC3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cccc(C(=O)Nc2c(C)[nH]c(=O)[nH]c2=O)c1
InChIInChI=1S/C19H18N4O6S/c1-11-16(18(25)22-19(26)20-11)21-17(24)12-6-5-7-13(10-12)30(27,28)23-14-8-3-4-9-15(14)29-2/h3-10,23H,1-2H3,(H,21,24)(H2,20,22,25,26)
InChIKeyWPDVVYRGILRWQP-UHFFFAOYSA-N
MW430.44 g/mol
LogP1.43
Rot. Bonds6

About 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide

3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide (PubChem CID 75468512) has the molecular formula C19H18N4O6S and a molecular weight of 430.44 g/mol. Its IUPAC name is 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide.

Molecular Properties

Compound Name3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide
PubChem CID75468512
Molecular FormulaC19H18N4O6S
Molecular Weight430.44 g/mol
Exact Mass430.09
IUPAC Name3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1cccc(C(=O)Nc2c(C)[nH]c(=O)[nH]c2=O)c1
InChIInChI=1S/C19H18N4O6S/c1-11-16(18(25)22-19(26)20-11)21-17(24)12-6-5-7-13(10-12)30(27,28)23-14-8-3-4-9-15(14)29-2/h3-10,23H,1-2H3,(H,21,24)(H2,20,22,25,26)
InChIKeyWPDVVYRGILRWQP-UHFFFAOYSA-N
XLogP1.43
TPSA150.22 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.44
LogP ≤ 51.43
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 75452209
N-(3-cyanophenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 9164272
N-benzyl-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 2329574
3-[(2-methoxyphenyl)sulfamoyl]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 29370167
propan-2-yl 3-[(2-methoxyphenyl)sulfamoyl]benzoate
CID 35468470
3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 51163765
3-methoxy-N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 2449372
2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide
CID 34743144
3-[(furan-2-carbonylamino)carbamoyl]-N-(2-methoxyphenyl)benzenesulfonamide
CID 2084798
3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylbutan-2-yl)benzamide
CID 51185857
3-[(2-methoxyphenyl)sulfamoyl]-N-(pyridin-4-ylmethyl)benzamide
CID 24686310

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide?
The IUPAC name of 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide (CID 75468512) is 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide.
What is the SMILES notation for 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide?
The canonical SMILES for 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide is COc1ccccc1NS(=O)(=O)c1cccc(C(=O)Nc2c(C)[nH]c(=O)[nH]c2=O)c1.
What is the InChIKey of 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide?
The InChIKey is WPDVVYRGILRWQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O6S/c1-11-16(18(25)22-19(26)20-11)21-17(24)12-6-5-7-13(10-12)30(27,28)23-14-8-3-4-9-15(14)29-2/h3-10,23H,1-2H3,(H,21,24)(H2,20,22,25,26).
What are the key properties of 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide?
3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide has a molecular weight of 430.44 g/mol, XLogP of 1.43, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methoxyphenyl)sulfamoyl]-N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)benzamide is sourced from PubChem (CID 75468512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).