5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine

C7H7N3O2S — CID 138040801

IUPAC5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine
SMILESCOc1nc(OC)c2scnc2n1
InChIInChI=1S/C7H7N3O2S/c1-11-6-4-5(8-3-13-4)9-7(10-6)12-2/h3H,1-2H3
InChIKeyYZFRJPBLRHCSTA-UHFFFAOYSA-N
MW197.22 g/mol
LogP1.10
Rot. Bonds2

About 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine

5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine (PubChem CID 138040801) has the molecular formula C7H7N3O2S and a molecular weight of 197.22 g/mol. Its IUPAC name is 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine.

Molecular Properties

Compound Name5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine
PubChem CID138040801
Molecular FormulaC7H7N3O2S
Molecular Weight197.22 g/mol
Exact Mass197.03
IUPAC Name5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine
SMILESCOc1nc(OC)c2scnc2n1
InChIInChI=1S/C7H7N3O2S/c1-11-6-4-5(8-3-13-4)9-7(10-6)12-2/h3H,1-2H3
InChIKeyYZFRJPBLRHCSTA-UHFFFAOYSA-N
XLogP1.10
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.22
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine 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 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine?
The IUPAC name of 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine (CID 138040801) is 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine.
What is the SMILES notation for 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine?
The canonical SMILES for 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine is COc1nc(OC)c2scnc2n1.
What is the InChIKey of 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine?
The InChIKey is YZFRJPBLRHCSTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2S/c1-11-6-4-5(8-3-13-4)9-7(10-6)12-2/h3H,1-2H3.
What are the key properties of 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine?
5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine has a molecular weight of 197.22 g/mol, XLogP of 1.10, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethoxy-[1,3]thiazolo[4,5-d]pyrimidine is sourced from PubChem (CID 138040801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).