3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide

C24H20N2OS — CID 122286288

IUPAC3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCc1cc(C)cc(C(=O)Nc2ccc(-c3csc(-c4ccccc4)n3)cc2)c1
InChIInChI=1S/C24H20N2OS/c1-16-12-17(2)14-20(13-16)23(27)25-21-10-8-18(9-11-21)22-15-28-24(26-22)19-6-4-3-5-7-19/h3-15H,1-2H3,(H,25,27)
InChIKeyZJDCMONDABIBRO-UHFFFAOYSA-N
MW384.50 g/mol
LogP6.35
Rot. Bonds4

About 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide

3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide (PubChem CID 122286288) has the molecular formula C24H20N2OS and a molecular weight of 384.50 g/mol. Its IUPAC name is 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide
PubChem CID122286288
Molecular FormulaC24H20N2OS
Molecular Weight384.50 g/mol
Exact Mass384.13
IUPAC Name3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCc1cc(C)cc(C(=O)Nc2ccc(-c3csc(-c4ccccc4)n3)cc2)c1
InChIInChI=1S/C24H20N2OS/c1-16-12-17(2)14-20(13-16)23(27)25-21-10-8-18(9-11-21)22-15-28-24(26-22)19-6-4-3-5-7-19/h3-15H,1-2H3,(H,25,27)
InChIKeyZJDCMONDABIBRO-UHFFFAOYSA-N
XLogP6.35
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.50
LogP ≤ 56.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-pyridin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 31263128
5-bromo-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
CID 122286371
2-phenyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]imidazo[1,2-a]pyridine-7-carboxamide
CID 108810602
4-(4-methylphenyl)-4-oxo-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]butanamide
CID 108727454
1-(3-chloro-4-methylphenyl)-3-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]urea
CID 122286290
N-methyl-4-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 1483692
N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine-7-carboxamide
CID 108810689
1-(4-chlorophenyl)-3-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]urea
CID 108780501
1-(3,5-difluorophenyl)-3-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]urea
CID 122286296
2-methyl-3-nitro-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 108727476
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 24532559
2,2-dimethyl-4-oxo-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]-3H-chromene-6-carboxamide
CID 108727448

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide?
The IUPAC name of 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide (CID 122286288) is 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide?
The canonical SMILES for 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide is Cc1cc(C)cc(C(=O)Nc2ccc(-c3csc(-c4ccccc4)n3)cc2)c1.
What is the InChIKey of 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide?
The InChIKey is ZJDCMONDABIBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2OS/c1-16-12-17(2)14-20(13-16)23(27)25-21-10-8-18(9-11-21)22-15-28-24(26-22)19-6-4-3-5-7-19/h3-15H,1-2H3,(H,25,27).
What are the key properties of 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide?
3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide has a molecular weight of 384.50 g/mol, XLogP of 6.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 122286288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).