2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione

C11H15N3O2S — CID 171444808

IUPAC2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
SMILESCC(C)c1nc2c(=O)n(C(C)C)c(=O)[nH]c2s1
InChIInChI=1S/C11H15N3O2S/c1-5(2)8-12-7-9(17-8)13-11(16)14(6(3)4)10(7)15/h5-6H,1-4H3,(H,13,16)
InChIKeyFWRJLVVAPZOULD-UHFFFAOYSA-N
MW253.33 g/mol
LogP1.85
Rot. Bonds2

About 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione

2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione (PubChem CID 171444808) has the molecular formula C11H15N3O2S and a molecular weight of 253.33 g/mol. Its IUPAC name is 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione.

Molecular Properties

Compound Name2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
PubChem CID171444808
Molecular FormulaC11H15N3O2S
Molecular Weight253.33 g/mol
Exact Mass253.09
IUPAC Name2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
SMILESCC(C)c1nc2c(=O)n(C(C)C)c(=O)[nH]c2s1
InChIInChI=1S/C11H15N3O2S/c1-5(2)8-12-7-9(17-8)13-11(16)14(6(3)4)10(7)15/h5-6H,1-4H3,(H,13,16)
InChIKeyFWRJLVVAPZOULD-UHFFFAOYSA-N
XLogP1.85
TPSA67.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione 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

2-(Ethylamino)-4,6-dimethyl[1,3]thiazolo[5,4-d]pyrimidine-5,7(4H,6H)-dione
CID 238211
2-(1,1-difluoroethyl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 117982791
2-(difluoromethyl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 117986186
2-methyl-4H-thiazolo[5,4-d]pyrimidine-5,7-dione
CID 345642
2-(Butylamino)-4,6-dimethyl-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 343705
5,6-Dihydro-6-methyl-2-(methylthio)-5-thioxothiazolo[5,4-d]pyrimidin-7(4H)-one
CID 13253039
2-propyl-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 58333752
2-ethyl-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 58334128
2,6-dimethyl-5-methylidene-4H-[1,3]thiazolo[5,4-d]pyrimidin-7-one
CID 60079317
2,6-dimethyl-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 67557930
2-propan-2-yl-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 117982790
2-cyclopropyl-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione
CID 117982793

Frequently Asked Questions

What is the IUPAC name of 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
The IUPAC name of 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione (CID 171444808) is 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione.
What is the SMILES notation for 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
The canonical SMILES for 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione is CC(C)c1nc2c(=O)n(C(C)C)c(=O)[nH]c2s1.
What is the InChIKey of 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
The InChIKey is FWRJLVVAPZOULD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2S/c1-5(2)8-12-7-9(17-8)13-11(16)14(6(3)4)10(7)15/h5-6H,1-4H3,(H,13,16).
What are the key properties of 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione?
2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione has a molecular weight of 253.33 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(propan-2-yl)-4H-[1,3]thiazolo[5,4-d]pyrimidine-5,7-dione is sourced from PubChem (CID 171444808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).