1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one

C20H16FN5OS — CID 118937902

IUPAC1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one
SMILESO=C1N(Cc2nccs2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C20H16FN5OS/c21-15-4-1-2-5-18(15)26-17-7-3-6-16(14(17)12-23-26)25-10-9-24(20(25)27)13-19-22-8-11-28-19/h1-8,11-12H,9-10,13H2
InChIKeyYYWYLBZFMANRQJ-UHFFFAOYSA-N
MW393.45 g/mol
LogP4.06
Rot. Bonds4

About 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one

1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one (PubChem CID 118937902) has the molecular formula C20H16FN5OS and a molecular weight of 393.45 g/mol. Its IUPAC name is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one
PubChem CID118937902
Molecular FormulaC20H16FN5OS
Molecular Weight393.45 g/mol
Exact Mass393.11
IUPAC Name1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one
SMILESO=C1N(Cc2nccs2)CCN1c1cccc2c1cnn2-c1ccccc1F
InChIInChI=1S/C20H16FN5OS/c21-15-4-1-2-5-18(15)26-17-7-3-6-16(14(17)12-23-26)25-10-9-24(20(25)27)13-19-22-8-11-28-19/h1-8,11-12H,9-10,13H2
InChIKeyYYWYLBZFMANRQJ-UHFFFAOYSA-N
XLogP4.06
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.45
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one?
The IUPAC name of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one (CID 118937902) is 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one.
What is the SMILES notation for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one?
The canonical SMILES for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one is O=C1N(Cc2nccs2)CCN1c1cccc2c1cnn2-c1ccccc1F.
What is the InChIKey of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one?
The InChIKey is YYWYLBZFMANRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN5OS/c21-15-4-1-2-5-18(15)26-17-7-3-6-16(14(17)12-23-26)25-10-9-24(20(25)27)13-19-22-8-11-28-19/h1-8,11-12H,9-10,13H2.
What are the key properties of 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one?
1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one has a molecular weight of 393.45 g/mol, XLogP of 4.06, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-fluorophenyl)indazol-4-yl]-3-(1,3-thiazol-2-ylmethyl)imidazolidin-2-one is sourced from PubChem (CID 118937902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).