3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide

C24H20N2OS — CID 126212032

IUPAC3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide
SMILESCc1cccc(C(=O)/N=c2\sc(-c3ccccc3)c(-c3ccccc3)n2C)c1
InChIInChI=1S/C24H20N2OS/c1-17-10-9-15-20(16-17)23(27)25-24-26(2)21(18-11-5-3-6-12-18)22(28-24)19-13-7-4-8-14-19/h3-16H,1-2H3/b25-24-
InChIKeyKGWMUDMYRFJCPY-IZHYLOQSSA-N
MW384.50 g/mol
LogP5.47
Rot. Bonds3

About 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide

3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide (PubChem CID 126212032) has the molecular formula C24H20N2OS and a molecular weight of 384.50 g/mol. Its IUPAC name is 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide.

Molecular Properties

Compound Name3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide
PubChem CID126212032
Molecular FormulaC24H20N2OS
Molecular Weight384.50 g/mol
Exact Mass384.13
IUPAC Name3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide
SMILESCc1cccc(C(=O)/N=c2\sc(-c3ccccc3)c(-c3ccccc3)n2C)c1
InChIInChI=1S/C24H20N2OS/c1-17-10-9-15-20(16-17)23(27)25-24-26(2)21(18-11-5-3-6-12-18)22(28-24)19-13-7-4-8-14-19/h3-16H,1-2H3/b25-24-
InChIKeyKGWMUDMYRFJCPY-IZHYLOQSSA-N
XLogP5.47
TPSA34.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.50
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(3,4-dimethylphenyl)-3-methyl-5-phenyl-1,3-thiazol-2-ylidene]-3-fluorobenzamide
CID 126210567
N-[3-methyl-5-phenyl-4-(4-phenylphenyl)-1,3-thiazol-2-ylidene]pyridine-3-carboxamide
CID 3448125
4-tert-butyl-N-[3-methyl-5-phenyl-4-(4-phenylphenyl)-1,3-thiazol-2-ylidene]benzamide
CID 126201256
N-[4,5-bis(4-methoxyphenyl)-3-methyl-1,3-thiazol-2-ylidene]-3-chlorobenzamide
CID 126203998
2-chloro-N-[4-(4-methoxyphenyl)-3-methyl-5-phenyl-1,3-thiazol-2-ylidene]-4-methylbenzamide
CID 126198964
2-chloro-N-[4-(3,4-dimethylphenyl)-3-methyl-5-phenyl-1,3-thiazol-2-ylidene]-4-methylbenzamide
CID 126213122
N-[3-(2-hydroxyethyl)-4,5-diphenyl-1,3-thiazol-2-ylidene]benzamide
CID 1008314
N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-3-methylbenzamide
CID 40996459
N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-4-phenylbenzamide
CID 4984113
N-[4,5-bis(4-methoxyphenyl)-3-methyl-1,3-thiazol-2-ylidene]-4-bromobenzamide
CID 126204701
N-[4,5-bis(4-methoxyphenyl)-3-methyl-1,3-thiazol-2-ylidene]-4-fluorobenzamide
CID 126203694
N-[4-(4-fluorophenyl)-3,5-dimethyl-1,3-thiazol-2-ylidene]-3-methoxybenzamide
CID 1021952

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide?
The IUPAC name of 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide (CID 126212032) is 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide.
What is the SMILES notation for 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide?
The canonical SMILES for 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide is Cc1cccc(C(=O)/N=c2\sc(-c3ccccc3)c(-c3ccccc3)n2C)c1.
What is the InChIKey of 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide?
The InChIKey is KGWMUDMYRFJCPY-IZHYLOQSSA-N. The full InChI is InChI=1S/C24H20N2OS/c1-17-10-9-15-20(16-17)23(27)25-24-26(2)21(18-11-5-3-6-12-18)22(28-24)19-13-7-4-8-14-19/h3-16H,1-2H3/b25-24-.
What are the key properties of 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide?
3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide has a molecular weight of 384.50 g/mol, XLogP of 5.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-methyl-4,5-diphenyl-1,3-thiazol-2-ylidene)benzamide is sourced from PubChem (CID 126212032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).