1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea

C14H13FN6O4S — CID 14421895

IUPAC1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea
SMILESCOc1cc(C)nc(NC(=O)NS(=O)(=O)c2c(F)nc3ccccn23)n1
InChIInChI=1S/C14H13FN6O4S/c1-8-7-10(25-2)18-13(16-8)19-14(22)20-26(23,24)12-11(15)17-9-5-3-4-6-21(9)12/h3-7H,1-2H3,(H2,16,18,19,20,22)
InChIKeyXQTBMGOFFSMIDP-UHFFFAOYSA-N
MW380.36 g/mol
LogP1.09
Rot. Bonds4

About 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea

1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea (PubChem CID 14421895) has the molecular formula C14H13FN6O4S and a molecular weight of 380.36 g/mol. Its IUPAC name is 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea.

Molecular Properties

Compound Name1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea
PubChem CID14421895
Molecular FormulaC14H13FN6O4S
Molecular Weight380.36 g/mol
Exact Mass380.07
IUPAC Name1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea
SMILESCOc1cc(C)nc(NC(=O)NS(=O)(=O)c2c(F)nc3ccccn23)n1
InChIInChI=1S/C14H13FN6O4S/c1-8-7-10(25-2)18-13(16-8)19-14(22)20-26(23,24)12-11(15)17-9-5-3-4-6-21(9)12/h3-7H,1-2H3,(H2,16,18,19,20,22)
InChIKeyXQTBMGOFFSMIDP-UHFFFAOYSA-N
XLogP1.09
TPSA127.58 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.36
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea 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

Sulfosulfuron
CID 86426
Imazosulfuron
CID 92433
3-Fluoro-N-({imidazo[1,2-A]pyridin-2-YL}methyl)-4-methoxybenzene-1-sulfonamide
CID 6623900
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-methylsulfanylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421848
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-ethylsulfanylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421849
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-methylsulfinylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421854
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-ethylsulfinylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421855
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-methylsulfonylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421858
1-(4-Chloro-6-methoxypyrimidin-2-yl)-3-(2-ethylsulfonylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 76334172
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-propylsulfanylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421850
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-propan-2-ylsulfanylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421851
1-(4,6-Dimethoxypyrimidin-2-yl)-3-(2-phenylsulfanylimidazo[1,2-a]pyridin-3-yl)sulfonylurea
CID 14421853

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea?
The IUPAC name of 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea (CID 14421895) is 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea.
What is the SMILES notation for 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea?
The canonical SMILES for 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea is COc1cc(C)nc(NC(=O)NS(=O)(=O)c2c(F)nc3ccccn23)n1.
What is the InChIKey of 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea?
The InChIKey is XQTBMGOFFSMIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN6O4S/c1-8-7-10(25-2)18-13(16-8)19-14(22)20-26(23,24)12-11(15)17-9-5-3-4-6-21(9)12/h3-7H,1-2H3,(H2,16,18,19,20,22).
What are the key properties of 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea?
1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea has a molecular weight of 380.36 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroimidazo[1,2-a]pyridin-3-yl)sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea is sourced from PubChem (CID 14421895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).