N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide

C19H15N3O2S — CID 42271413

IUPACN-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCOc1cccc(NC(=O)c2csc3nc(-c4ccccc4)cn23)c1
InChIInChI=1S/C19H15N3O2S/c1-24-15-9-5-8-14(10-15)20-18(23)17-12-25-19-21-16(11-22(17)19)13-6-3-2-4-7-13/h2-12H,1H3,(H,20,23)
InChIKeyQCUGMKNUILSIAB-UHFFFAOYSA-N
MW349.42 g/mol
LogP4.32
Rot. Bonds4

About N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide

N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide (PubChem CID 42271413) has the molecular formula C19H15N3O2S and a molecular weight of 349.42 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
PubChem CID42271413
Molecular FormulaC19H15N3O2S
Molecular Weight349.42 g/mol
Exact Mass349.09
IUPAC NameN-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide
SMILESCOc1cccc(NC(=O)c2csc3nc(-c4ccccc4)cn23)c1
InChIInChI=1S/C19H15N3O2S/c1-24-15-9-5-8-14(10-15)20-18(23)17-12-25-19-21-16(11-22(17)19)13-6-3-2-4-7-13/h2-12H,1H3,(H,20,23)
InChIKeyQCUGMKNUILSIAB-UHFFFAOYSA-N
XLogP4.32
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide (CID 42271413) is N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide is COc1cccc(NC(=O)c2csc3nc(-c4ccccc4)cn23)c1.
What is the InChIKey of N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
The InChIKey is QCUGMKNUILSIAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2S/c1-24-15-9-5-8-14(10-15)20-18(23)17-12-25-19-21-16(11-22(17)19)13-6-3-2-4-7-13/h2-12H,1H3,(H,20,23).
What are the key properties of N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide?
N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide has a molecular weight of 349.42 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-6-phenylimidazo[2,1-b][1,3]thiazole-3-carboxamide is sourced from PubChem (CID 42271413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).