N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide

C30H22N4OS — CID 108810689

IUPACN-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
SMILESCc1ccccc1-c1nc(-c2ccc(NC(=O)c3ccn4cc(-c5ccccc5)nc4c3)cc2)cs1
InChIInChI=1S/C30H22N4OS/c1-20-7-5-6-10-25(20)30-33-27(19-36-30)22-11-13-24(14-12-22)31-29(35)23-15-16-34-18-26(32-28(34)17-23)21-8-3-2-4-9-21/h2-19H,1H3,(H,31,35)
InChIKeyZVRKQPWKNINBJP-UHFFFAOYSA-N
MW486.60 g/mol
LogP7.35
Rot. Bonds5

About N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide

N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide (PubChem CID 108810689) has the molecular formula C30H22N4OS and a molecular weight of 486.60 g/mol. Its IUPAC name is N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
PubChem CID108810689
Molecular FormulaC30H22N4OS
Molecular Weight486.60 g/mol
Exact Mass486.15
IUPAC NameN-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
SMILESCc1ccccc1-c1nc(-c2ccc(NC(=O)c3ccn4cc(-c5ccccc5)nc4c3)cc2)cs1
InChIInChI=1S/C30H22N4OS/c1-20-7-5-6-10-25(20)30-33-27(19-36-30)22-11-13-24(14-12-22)31-29(35)23-15-16-34-18-26(32-28(34)17-23)21-8-3-2-4-9-21/h2-19H,1H3,(H,31,35)
InChIKeyZVRKQPWKNINBJP-UHFFFAOYSA-N
XLogP7.35
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.60
LogP ≤ 57.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]imidazo[1,2-a]pyridine-7-carboxamide
CID 108810602
methyl 4-[(2-phenylimidazo[1,2-a]pyridine-7-carbonyl)amino]benzoate
CID 108801388
N-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-4-phenylbenzamide
CID 121089744
N-(5-acetamido-2-methylphenyl)-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
CID 108788562
N-(3-acetamidophenyl)-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
CID 108801394
N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-1,3-dioxo-2-propan-2-ylisoindole-5-carboxamide
CID 108770069
3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 122286288
N-(1,3-dioxoisoindol-5-yl)-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
CID 108788490
4-[(4,6-dimethylpyrimidin-2-yl)amino]-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]benzamide
CID 108748089
5-methyl-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]furan-2-carboxamide
CID 108748108
methyl 3-[(2-phenylimidazo[1,2-a]pyridine-7-carbonyl)amino]benzoate
CID 108801384
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbenzamide
CID 40570291

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
The IUPAC name of N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide (CID 108810689) is N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
The canonical SMILES for N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide is Cc1ccccc1-c1nc(-c2ccc(NC(=O)c3ccn4cc(-c5ccccc5)nc4c3)cc2)cs1.
What is the InChIKey of N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
The InChIKey is ZVRKQPWKNINBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N4OS/c1-20-7-5-6-10-25(20)30-33-27(19-36-30)22-11-13-24(14-12-22)31-29(35)23-15-16-34-18-26(32-28(34)17-23)21-8-3-2-4-9-21/h2-19H,1H3,(H,31,35).
What are the key properties of N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide?
N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide has a molecular weight of 486.60 g/mol, XLogP of 7.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide is sourced from PubChem (CID 108810689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).