4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide

C8H10N2O3S — CID 11745974

IUPAC4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide
SMILESCOc1nc(C)nc2c1CS(=O)(=O)C2
InChIInChI=1S/C8H10N2O3S/c1-5-9-7-4-14(11,12)3-6(7)8(10-5)13-2/h3-4H2,1-2H3
InChIKeyKAPQHCVTTWKQHN-UHFFFAOYSA-N
MW214.25 g/mol
LogP0.22
Rot. Bonds1

About 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide

4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide (PubChem CID 11745974) has the molecular formula C8H10N2O3S and a molecular weight of 214.25 g/mol. Its IUPAC name is 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide.

Molecular Properties

Compound Name4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide
PubChem CID11745974
Molecular FormulaC8H10N2O3S
Molecular Weight214.25 g/mol
Exact Mass214.04
IUPAC Name4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide
SMILESCOc1nc(C)nc2c1CS(=O)(=O)C2
InChIInChI=1S/C8H10N2O3S/c1-5-9-7-4-14(11,12)3-6(7)8(10-5)13-2/h3-4H2,1-2H3
InChIKeyKAPQHCVTTWKQHN-UHFFFAOYSA-N
XLogP0.22
TPSA69.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.25
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide 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 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide?
The IUPAC name of 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide (CID 11745974) is 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide.
What is the SMILES notation for 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide?
The canonical SMILES for 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide is COc1nc(C)nc2c1CS(=O)(=O)C2.
What is the InChIKey of 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide?
The InChIKey is KAPQHCVTTWKQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3S/c1-5-9-7-4-14(11,12)3-6(7)8(10-5)13-2/h3-4H2,1-2H3.
What are the key properties of 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide?
4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide has a molecular weight of 214.25 g/mol, XLogP of 0.22, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methyl-5,7-dihydrothieno[3,4-d]pyrimidine 6,6-dioxide is sourced from PubChem (CID 11745974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).