5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione

C10H10FN3O3S — CID 114139770

IUPAC5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione
SMILESCc1nc(CCn2c(O)c(F)c(=O)[nH]c2=O)cs1
InChIInChI=1S/C10H10FN3O3S/c1-5-12-6(4-18-5)2-3-14-9(16)7(11)8(15)13-10(14)17/h4,16H,2-3H2,1H3,(H,13,15,17)
InChIKeyQKFQLEYCCPLMML-UHFFFAOYSA-N
MW271.27 g/mol
LogP0.39
Rot. Bonds3

About 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione

5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione (PubChem CID 114139770) has the molecular formula C10H10FN3O3S and a molecular weight of 271.27 g/mol. Its IUPAC name is 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione
PubChem CID114139770
Molecular FormulaC10H10FN3O3S
Molecular Weight271.27 g/mol
Exact Mass271.04
IUPAC Name5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione
SMILESCc1nc(CCn2c(O)c(F)c(=O)[nH]c2=O)cs1
InChIInChI=1S/C10H10FN3O3S/c1-5-12-6(4-18-5)2-3-14-9(16)7(11)8(15)13-10(14)17/h4,16H,2-3H2,1H3,(H,13,15,17)
InChIKeyQKFQLEYCCPLMML-UHFFFAOYSA-N
XLogP0.39
TPSA87.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-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

1-Methyl-5-(4-methyl-2-thiazolyl)-2,4(1H,3H)-pyrimidinedione
CID 47002148
6-chloro-5-fluoro-3-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]-1H-pyrimidine-2,4-dione
CID 104372482
6-chloro-5-fluoro-3-[2-(1,3-thiazol-4-yl)ethyl]-1H-pyrimidine-2,4-dione
CID 104372569
5-Fluoro-6-hydroxy-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrimidine-2,4-dione
CID 112599942
5-Fluoro-6-hydroxy-1-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrimidine-2,4-dione
CID 112599973
5-Fluoro-6-hydroxy-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidine-2,4-dione
CID 112600592
5-Fluoro-6-hydroxy-1-[2-(1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione
CID 112600708
5-Fluoro-6-hydroxy-1-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrimidine-2,4-dione
CID 112601014
6-chloro-5-fluoro-3-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-1H-pyrimidine-2,4-dione
CID 113404192
6-chloro-5-fluoro-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-1H-pyrimidine-2,4-dione
CID 114139816
6-Amino-1-ethyl-5-(2-methyl-1,3-thiazol-4-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 7131123
6-Amino-5-(2-methyl-1,3-thiazol-4-yl)-1-propylpyrimidine-2,4-dione
CID 8004839

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione?
The IUPAC name of 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione (CID 114139770) is 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione.
What is the SMILES notation for 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione?
The canonical SMILES for 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione is Cc1nc(CCn2c(O)c(F)c(=O)[nH]c2=O)cs1.
What is the InChIKey of 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione?
The InChIKey is QKFQLEYCCPLMML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O3S/c1-5-12-6(4-18-5)2-3-14-9(16)7(11)8(15)13-10(14)17/h4,16H,2-3H2,1H3,(H,13,15,17).
What are the key properties of 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione?
5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione has a molecular weight of 271.27 g/mol, XLogP of 0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-hydroxy-1-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrimidine-2,4-dione is sourced from PubChem (CID 114139770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).