4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide

C23H19N7O3S — CID 71282282

IUPAC4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide
SMILESCc1nc(-c2ccc(C)c(NC(=O)c3cnc4ccc(-c5sc(C(N)=O)nc5C)cn34)c2)no1
InChIInChI=1S/C23H19N7O3S/c1-11-4-5-14(21-27-13(3)33-29-21)8-16(11)28-22(32)17-9-25-18-7-6-15(10-30(17)18)19-12(2)26-23(34-19)20(24)31/h4-10H,1-3H3,(H2,24,31)(H,28,32)
InChIKeyVCTJOWABFYYALX-UHFFFAOYSA-N
MW473.52 g/mol
LogP3.78
Rot. Bonds5

About 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide

4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide (PubChem CID 71282282) has the molecular formula C23H19N7O3S and a molecular weight of 473.52 g/mol. Its IUPAC name is 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide
PubChem CID71282282
Molecular FormulaC23H19N7O3S
Molecular Weight473.52 g/mol
Exact Mass473.13
IUPAC Name4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide
SMILESCc1nc(-c2ccc(C)c(NC(=O)c3cnc4ccc(-c5sc(C(N)=O)nc5C)cn34)c2)no1
InChIInChI=1S/C23H19N7O3S/c1-11-4-5-14(21-27-13(3)33-29-21)8-16(11)28-22(32)17-9-25-18-7-6-15(10-30(17)18)19-12(2)26-23(34-19)20(24)31/h4-10H,1-3H3,(H2,24,31)(H,28,32)
InChIKeyVCTJOWABFYYALX-UHFFFAOYSA-N
XLogP3.78
TPSA141.30 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.52
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide?
The IUPAC name of 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide (CID 71282282) is 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide?
The canonical SMILES for 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide is Cc1nc(-c2ccc(C)c(NC(=O)c3cnc4ccc(-c5sc(C(N)=O)nc5C)cn34)c2)no1.
What is the InChIKey of 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide?
The InChIKey is VCTJOWABFYYALX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N7O3S/c1-11-4-5-14(21-27-13(3)33-29-21)8-16(11)28-22(32)17-9-25-18-7-6-15(10-30(17)18)19-12(2)26-23(34-19)20(24)31/h4-10H,1-3H3,(H2,24,31)(H,28,32).
What are the key properties of 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide?
4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide has a molecular weight of 473.52 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-[3-[[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 71282282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).