4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide

C14H17N3O4S — CID 122302660

IUPAC4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2c(C)nc(OC)nc2C)cc1
InChIInChI=1S/C14H17N3O4S/c1-9-13(10(2)16-14(15-9)21-4)17-22(18,19)12-7-5-11(20-3)6-8-12/h5-8,17H,1-4H3
InChIKeyXKDUTTWSTRMIRG-UHFFFAOYSA-N
MW323.37 g/mol
LogP1.91
Rot. Bonds5

About 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide

4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide (PubChem CID 122302660) has the molecular formula C14H17N3O4S and a molecular weight of 323.37 g/mol. Its IUPAC name is 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide
PubChem CID122302660
Molecular FormulaC14H17N3O4S
Molecular Weight323.37 g/mol
Exact Mass323.09
IUPAC Name4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2c(C)nc(OC)nc2C)cc1
InChIInChI=1S/C14H17N3O4S/c1-9-13(10(2)16-14(15-9)21-4)17-22(18,19)12-7-5-11(20-3)6-8-12/h5-8,17H,1-4H3
InChIKeyXKDUTTWSTRMIRG-UHFFFAOYSA-N
XLogP1.91
TPSA90.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.37
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(4,6-dimethyl-2-phenoxypyrimidin-5-yl)-4-methoxybenzenesulfonamide
CID 122303656
4-methoxy-N-(2,4,6-trimethylphenyl)benzenesulfonamide
CID 743974
N-(4,6-dimethylpyrimidin-2-yl)-4-methoxybenzenesulfonamide
CID 717519
4-methoxy-N-(6-methyl-2-pyridinyl)benzenesulfonamide
CID 3857714
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-methoxybenzenesulfonamide
CID 51284216
N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-4-ethylbenzenesulfonamide
CID 121137078
4-methoxy-N-phenylbenzenesulfonamide
CID 835273
N-(4,6-dimethyl-2-phenoxypyrimidin-5-yl)-4-methoxy-3-methylbenzenesulfonamide
CID 122303666
4-methoxy-N-(5-methoxy-2-methylphenyl)benzenesulfonamide
CID 4564561
N-[4-(4,6-dimethylpyrimidin-2-yl)oxyphenyl]-4-methoxybenzenesulfonamide
CID 108783146
N-(2-amino-4-methylphenyl)-4-methoxybenzenesulfonamide
CID 43259140
4-chloro-N-(4-methoxyphenyl)benzenesulfonamide
CID 722849

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide (CID 122302660) is 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2c(C)nc(OC)nc2C)cc1.
What is the InChIKey of 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide?
The InChIKey is XKDUTTWSTRMIRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O4S/c1-9-13(10(2)16-14(15-9)21-4)17-22(18,19)12-7-5-11(20-3)6-8-12/h5-8,17H,1-4H3.
What are the key properties of 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide?
4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide has a molecular weight of 323.37 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide is sourced from PubChem (CID 122302660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).