2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide

C23H18N4O3S — CID 56530502

IUPAC2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide
SMILESCc1sc(-c2ccco2)nc1C(=O)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C23H18N4O3S/c1-15-21(26-23(31-15)19-8-5-11-29-19)22(28)25-16-6-4-7-18(12-16)30-14-17-13-27-10-3-2-9-20(27)24-17/h2-13H,14H2,1H3,(H,25,28)
InChIKeyMFNRNQMANZMOIQ-UHFFFAOYSA-N
MW430.49 g/mol
LogP5.19
Rot. Bonds6

About 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide

2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide (PubChem CID 56530502) has the molecular formula C23H18N4O3S and a molecular weight of 430.49 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide
PubChem CID56530502
Molecular FormulaC23H18N4O3S
Molecular Weight430.49 g/mol
Exact Mass430.11
IUPAC Name2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide
SMILESCc1sc(-c2ccco2)nc1C(=O)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C23H18N4O3S/c1-15-21(26-23(31-15)19-8-5-11-29-19)22(28)25-16-6-4-7-18(12-16)30-14-17-13-27-10-3-2-9-20(27)24-17/h2-13H,14H2,1H3,(H,25,28)
InChIKeyMFNRNQMANZMOIQ-UHFFFAOYSA-N
XLogP5.19
TPSA81.66 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.49
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide (CID 56530502) is 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide is Cc1sc(-c2ccco2)nc1C(=O)Nc1cccc(OCc2cn3ccccc3n2)c1.
What is the InChIKey of 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide?
The InChIKey is MFNRNQMANZMOIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O3S/c1-15-21(26-23(31-15)19-8-5-11-29-19)22(28)25-16-6-4-7-18(12-16)30-14-17-13-27-10-3-2-9-20(27)24-17/h2-13H,14H2,1H3,(H,25,28).
What are the key properties of 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide has a molecular weight of 430.49 g/mol, XLogP of 5.19, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-5-methyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 56530502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).