2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide

C18H16N4O4S — CID 1084466

IUPAC2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1
InChIInChI=1S/C18H16N4O4S/c1-26-16-6-3-2-5-15(16)17(23)21-13-7-9-14(10-8-13)27(24,25)22-18-19-11-4-12-20-18/h2-12H,1H3,(H,21,23)(H,19,20,22)
InChIKeyOXZJZDWZEMQVRE-UHFFFAOYSA-N
MW384.42 g/mol
LogP2.54
Rot. Bonds6

About 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide

2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide (PubChem CID 1084466) has the molecular formula C18H16N4O4S and a molecular weight of 384.42 g/mol. Its IUPAC name is 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
PubChem CID1084466
Molecular FormulaC18H16N4O4S
Molecular Weight384.42 g/mol
Exact Mass384.09
IUPAC Name2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1
InChIInChI=1S/C18H16N4O4S/c1-26-16-6-3-2-5-15(16)17(23)21-13-7-9-14(10-8-13)27(24,25)22-18-19-11-4-12-20-18/h2-12H,1H3,(H,21,23)(H,19,20,22)
InChIKeyOXZJZDWZEMQVRE-UHFFFAOYSA-N
XLogP2.54
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.42
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide (CID 1084466) is 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide is COc1ccccc1C(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1.
What is the InChIKey of 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
The InChIKey is OXZJZDWZEMQVRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O4S/c1-26-16-6-3-2-5-15(16)17(23)21-13-7-9-14(10-8-13)27(24,25)22-18-19-11-4-12-20-18/h2-12H,1H3,(H,21,23)(H,19,20,22).
What are the key properties of 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide?
2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide has a molecular weight of 384.42 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 1084466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).