2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide

C24H19BrN2OS — CID 108748097

IUPAC2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
SMILESCc1ccccc1-c1nc(-c2ccc(NC(=O)Cc3ccc(Br)cc3)cc2)cs1
InChIInChI=1S/C24H19BrN2OS/c1-16-4-2-3-5-21(16)24-27-22(15-29-24)18-8-12-20(13-9-18)26-23(28)14-17-6-10-19(25)11-7-17/h2-13,15H,14H2,1H3,(H,26,28)
InChIKeyAPRMTTGMJAITQD-UHFFFAOYSA-N
MW463.40 g/mol
LogP6.73
Rot. Bonds5

About 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide

2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide (PubChem CID 108748097) has the molecular formula C24H19BrN2OS and a molecular weight of 463.40 g/mol. Its IUPAC name is 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide.

Molecular Properties

Compound Name2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
PubChem CID108748097
Molecular FormulaC24H19BrN2OS
Molecular Weight463.40 g/mol
Exact Mass462.04
IUPAC Name2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
SMILESCc1ccccc1-c1nc(-c2ccc(NC(=O)Cc3ccc(Br)cc3)cc2)cs1
InChIInChI=1S/C24H19BrN2OS/c1-16-4-2-3-5-21(16)24-27-22(15-29-24)18-8-12-20(13-9-18)26-23(28)14-17-6-10-19(25)11-7-17/h2-13,15H,14H2,1H3,(H,26,28)
InChIKeyAPRMTTGMJAITQD-UHFFFAOYSA-N
XLogP6.73
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.40
LogP ≤ 56.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylphenoxy)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 108748059
N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-4-oxo-4-phenylbutanamide
CID 108748072
N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]-2-(4-propylphenoxy)acetamide
CID 108770118
5-methyl-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]furan-2-carboxamide
CID 108748108
2-bromo-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]butanamide
CID 108748042
2-(1-adamantyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 108770065
2-(4-methoxyphenyl)-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 2978424
2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-N-phenylacetamide
CID 2213605
N-(3,5-dimethylphenyl)-2-[4-(2-pyridin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 100597321
N-[6-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]anilino]-6-oxohexyl]benzamide
CID 108748009
2-(2,4-dichlorophenoxy)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 108770123
2-[4-[[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetyl]amino]phenyl]acetamide
CID 31862065

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide?
The IUPAC name of 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide (CID 108748097) is 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide.
What is the SMILES notation for 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide?
The canonical SMILES for 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide is Cc1ccccc1-c1nc(-c2ccc(NC(=O)Cc3ccc(Br)cc3)cc2)cs1.
What is the InChIKey of 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide?
The InChIKey is APRMTTGMJAITQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19BrN2OS/c1-16-4-2-3-5-21(16)24-27-22(15-29-24)18-8-12-20(13-9-18)26-23(28)14-17-6-10-19(25)11-7-17/h2-13,15H,14H2,1H3,(H,26,28).
What are the key properties of 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide?
2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide has a molecular weight of 463.40 g/mol, XLogP of 6.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-N-[4-[2-(2-methylphenyl)-1,3-thiazol-4-yl]phenyl]acetamide is sourced from PubChem (CID 108748097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).