2,4-diphenyl-1,3-thiazole-5-carboxamide

C16H12N2OS — CID 47120010

IUPAC2,4-diphenyl-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1sc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C16H12N2OS/c17-15(19)14-13(11-7-3-1-4-8-11)18-16(20-14)12-9-5-2-6-10-12/h1-10H,(H2,17,19)
InChIKeyMHOVHNXAFTWFBF-UHFFFAOYSA-N
MW280.35 g/mol
LogP3.58
Rot. Bonds3

About 2,4-diphenyl-1,3-thiazole-5-carboxamide

2,4-diphenyl-1,3-thiazole-5-carboxamide (PubChem CID 47120010) has the molecular formula C16H12N2OS and a molecular weight of 280.35 g/mol. Its IUPAC name is 2,4-diphenyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2,4-diphenyl-1,3-thiazole-5-carboxamide
PubChem CID47120010
Molecular FormulaC16H12N2OS
Molecular Weight280.35 g/mol
Exact Mass280.07
IUPAC Name2,4-diphenyl-1,3-thiazole-5-carboxamide
SMILESNC(=O)c1sc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C16H12N2OS/c17-15(19)14-13(11-7-3-1-4-8-11)18-16(20-14)12-9-5-2-6-10-12/h1-10H,(H2,17,19)
InChIKeyMHOVHNXAFTWFBF-UHFFFAOYSA-N
XLogP3.58
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-bromophenyl)-2-phenyl-1,3-thiazole-5-carboxylic acid
CID 131954927
2-tert-butyl-4-phenyl-1,3-thiazole-5-carboxamide
CID 170588418
2-(4-hydroxyphenyl)-4-phenyl-1,3-thiazole-5-carboxylic acid
CID 136889078
2-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 66856088
4-phenyl-2-pyridin-3-yl-1,3-thiazole-5-carboxylic acid
CID 73012806
N-(4-aminocyclohexyl)-2,4-diphenyl-1,3-thiazole-5-carboxamide
CID 119477493
2,4-diphenyl-N-piperidin-1-yl-1,3-thiazole-5-carboxamide
CID 9083928
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-4-phenyl-1,3-thiazole-5-carboxamide;pyridine;hydrochloride
CID 159636120
ethyl 2-(1-oxidopyridin-1-ium-4-yl)-4-phenyl-1,3-thiazole-5-carboxylate
CID 66854770
N-(3-acetamidophenyl)-2,4-diphenyl-1,3-thiazole-5-carboxamide
CID 9074270
(2-naphthalen-2-yl-4-phenyl-1,3-thiazol-5-yl)-phenylmethanone
CID 147321417
2,4-diphenyl-N-(1H-1,2,4-triazol-5-yl)-1,3-thiazole-5-carboxamide
CID 30864538

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2,4-diphenyl-1,3-thiazole-5-carboxamide (CID 47120010) is 2,4-diphenyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2,4-diphenyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2,4-diphenyl-1,3-thiazole-5-carboxamide is NC(=O)c1sc(-c2ccccc2)nc1-c1ccccc1.
What is the InChIKey of 2,4-diphenyl-1,3-thiazole-5-carboxamide?
The InChIKey is MHOVHNXAFTWFBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2OS/c17-15(19)14-13(11-7-3-1-4-8-11)18-16(20-14)12-9-5-2-6-10-12/h1-10H,(H2,17,19).
What are the key properties of 2,4-diphenyl-1,3-thiazole-5-carboxamide?
2,4-diphenyl-1,3-thiazole-5-carboxamide has a molecular weight of 280.35 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 47120010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).