2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide

C17H12F2N2OS — CID 90626068

IUPAC2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCc1nc(-c2ccccc2NC(=O)c2ccc(F)cc2F)cs1
InChIInChI=1S/C17H12F2N2OS/c1-10-20-16(9-23-10)13-4-2-3-5-15(13)21-17(22)12-7-6-11(18)8-14(12)19/h2-9H,1H3,(H,21,22)
InChIKeyVQUKEOIIDWZLNR-UHFFFAOYSA-N
MW330.36 g/mol
LogP4.65
Rot. Bonds3

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

2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide (PubChem CID 90626068) has the molecular formula C17H12F2N2OS and a molecular weight of 330.36 g/mol. Its IUPAC name is 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
PubChem CID90626068
Molecular FormulaC17H12F2N2OS
Molecular Weight330.36 g/mol
Exact Mass330.06
IUPAC Name2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCc1nc(-c2ccccc2NC(=O)c2ccc(F)cc2F)cs1
InChIInChI=1S/C17H12F2N2OS/c1-10-20-16(9-23-10)13-4-2-3-5-15(13)21-17(22)12-7-6-11(18)8-14(12)19/h2-9H,1H3,(H,21,22)
InChIKeyVQUKEOIIDWZLNR-UHFFFAOYSA-N
XLogP4.65
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626071
1-(4-fluorophenyl)-3-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]urea
CID 90626921
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]pyridine-2-carboxamide
CID 90626104
3,4-dimethyl-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626115
2-(2-fluorophenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 90626191
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]propanamide
CID 90626039
3,4-dimethoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626060
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 73168690
N-[2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]phenyl]-2,4-dimethoxybenzamide
CID 121148552
1-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]-3-propan-2-ylurea
CID 90626941
1-methyl-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]-6-oxopyridazine-3-carboxamide
CID 90626205
6-methoxy-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]pyridazine-3-carboxamide
CID 90626314

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The IUPAC name of 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide (CID 90626068) is 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The canonical SMILES for 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide is Cc1nc(-c2ccccc2NC(=O)c2ccc(F)cc2F)cs1.
What is the InChIKey of 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
The InChIKey is VQUKEOIIDWZLNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F2N2OS/c1-10-20-16(9-23-10)13-4-2-3-5-15(13)21-17(22)12-7-6-11(18)8-14(12)19/h2-9H,1H3,(H,21,22).
What are the key properties of 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide?
2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide has a molecular weight of 330.36 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 90626068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).