N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide

C10H13N5O4S2 — CID 67833029

IUPACN-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide
SMILESCOc1cc(C)nc(NC(=O)N2CSC=C2S(N)(=O)=O)n1
InChIInChI=1S/C10H13N5O4S2/c1-6-3-7(19-2)13-9(12-6)14-10(16)15-5-20-4-8(15)21(11,17)18/h3-4H,5H2,1-2H3,(H2,11,17,18)(H,12,13,14,16)
InChIKeyMVHPWRHZWHUOIY-UHFFFAOYSA-N
MW331.38 g/mol
LogP0.42
Rot. Bonds3

About N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide

N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide (PubChem CID 67833029) has the molecular formula C10H13N5O4S2 and a molecular weight of 331.38 g/mol. Its IUPAC name is N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide
PubChem CID67833029
Molecular FormulaC10H13N5O4S2
Molecular Weight331.38 g/mol
Exact Mass331.04
IUPAC NameN-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide
SMILESCOc1cc(C)nc(NC(=O)N2CSC=C2S(N)(=O)=O)n1
InChIInChI=1S/C10H13N5O4S2/c1-6-3-7(19-2)13-9(12-6)14-10(16)15-5-20-4-8(15)21(11,17)18/h3-4H,5H2,1-2H3,(H2,11,17,18)(H,12,13,14,16)
InChIKeyMVHPWRHZWHUOIY-UHFFFAOYSA-N
XLogP0.42
TPSA127.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide 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 N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide?
The IUPAC name of N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide (CID 67833029) is N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide.
What is the SMILES notation for N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide?
The canonical SMILES for N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide is COc1cc(C)nc(NC(=O)N2CSC=C2S(N)(=O)=O)n1.
What is the InChIKey of N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide?
The InChIKey is MVHPWRHZWHUOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O4S2/c1-6-3-7(19-2)13-9(12-6)14-10(16)15-5-20-4-8(15)21(11,17)18/h3-4H,5H2,1-2H3,(H2,11,17,18)(H,12,13,14,16).
What are the key properties of N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide?
N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-6-methylpyrimidin-2-yl)-4-sulfamoyl-2H-1,3-thiazole-3-carboxamide is sourced from PubChem (CID 67833029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).