3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide

C23H20N4O3S — CID 55495018

IUPAC3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESO=C(Nc1c(-c2ccccc2)nc2ccccn12)c1cccc(N2CCCS2(=O)=O)c1
InChIInChI=1S/C23H20N4O3S/c28-23(18-10-6-11-19(16-18)27-14-7-15-31(27,29)30)25-22-21(17-8-2-1-3-9-17)24-20-12-4-5-13-26(20)22/h1-6,8-13,16H,7,14-15H2,(H,25,28)
InChIKeyQJWGSRGUSMBSSN-UHFFFAOYSA-N
MW432.51 g/mol
LogP3.79
Rot. Bonds4

About 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide

3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide (PubChem CID 55495018) has the molecular formula C23H20N4O3S and a molecular weight of 432.51 g/mol. Its IUPAC name is 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide.

Molecular Properties

Compound Name3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
PubChem CID55495018
Molecular FormulaC23H20N4O3S
Molecular Weight432.51 g/mol
Exact Mass432.13
IUPAC Name3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESO=C(Nc1c(-c2ccccc2)nc2ccccn12)c1cccc(N2CCCS2(=O)=O)c1
InChIInChI=1S/C23H20N4O3S/c28-23(18-10-6-11-19(16-18)27-14-7-15-31(27,29)30)25-22-21(17-8-2-1-3-9-17)24-20-12-4-5-13-26(20)22/h1-6,8-13,16H,7,14-15H2,(H,25,28)
InChIKeyQJWGSRGUSMBSSN-UHFFFAOYSA-N
XLogP3.79
TPSA83.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.51
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The IUPAC name of 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide (CID 55495018) is 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide.
What is the SMILES notation for 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The canonical SMILES for 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide is O=C(Nc1c(-c2ccccc2)nc2ccccn12)c1cccc(N2CCCS2(=O)=O)c1.
What is the InChIKey of 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The InChIKey is QJWGSRGUSMBSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O3S/c28-23(18-10-6-11-19(16-18)27-14-7-15-31(27,29)30)25-22-21(17-8-2-1-3-9-17)24-20-12-4-5-13-26(20)22/h1-6,8-13,16H,7,14-15H2,(H,25,28).
What are the key properties of 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide has a molecular weight of 432.51 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide is sourced from PubChem (CID 55495018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).