1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea

C20H15ClN4O — CID 121149709

IUPAC1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea
SMILESO=C(Nc1cccc(Cl)c1)Nc1ccccc1-c1cn2ccccc2n1
InChIInChI=1S/C20H15ClN4O/c21-14-6-5-7-15(12-14)22-20(26)24-17-9-2-1-8-16(17)18-13-25-11-4-3-10-19(25)23-18/h1-13H,(H2,22,24,26)
InChIKeyIMTGWZLMIUITTK-UHFFFAOYSA-N
MW362.82 g/mol
LogP5.30
Rot. Bonds3

About 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea

1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea (PubChem CID 121149709) has the molecular formula C20H15ClN4O and a molecular weight of 362.82 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea
PubChem CID121149709
Molecular FormulaC20H15ClN4O
Molecular Weight362.82 g/mol
Exact Mass362.09
IUPAC Name1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea
SMILESO=C(Nc1cccc(Cl)c1)Nc1ccccc1-c1cn2ccccc2n1
InChIInChI=1S/C20H15ClN4O/c21-14-6-5-7-15(12-14)22-20(26)24-17-9-2-1-8-16(17)18-13-25-11-4-3-10-19(25)23-18/h1-13H,(H2,22,24,26)
InChIKeyIMTGWZLMIUITTK-UHFFFAOYSA-N
XLogP5.30
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.82
LogP ≤ 55.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
The IUPAC name of 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea (CID 121149709) is 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea.
What is the SMILES notation for 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
The canonical SMILES for 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea is O=C(Nc1cccc(Cl)c1)Nc1ccccc1-c1cn2ccccc2n1.
What is the InChIKey of 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
The InChIKey is IMTGWZLMIUITTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O/c21-14-6-5-7-15(12-14)22-20(26)24-17-9-2-1-8-16(17)18-13-25-11-4-3-10-19(25)23-18/h1-13H,(H2,22,24,26).
What are the key properties of 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea?
1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea has a molecular weight of 362.82 g/mol, XLogP of 5.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-(2-imidazo[1,2-a]pyridin-2-ylphenyl)urea is sourced from PubChem (CID 121149709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).