N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

C23H18FN3O4S — CID 24659708

IUPACN-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESCS(=O)(=O)Nc1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1F
InChIInChI=1S/C23H18FN3O4S/c1-32(29,30)27-20-13-16(11-12-19(20)24)26-22(28)17-9-5-6-10-18(17)23-25-14-21(31-23)15-7-3-2-4-8-15/h2-14,27H,1H3,(H,26,28)
InChIKeyYDRWTGVVWKRPBD-UHFFFAOYSA-N
MW451.48 g/mol
LogP4.77
Rot. Bonds6

About N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (PubChem CID 24659708) has the molecular formula C23H18FN3O4S and a molecular weight of 451.48 g/mol. Its IUPAC name is N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.

Molecular Properties

Compound NameN-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
PubChem CID24659708
Molecular FormulaC23H18FN3O4S
Molecular Weight451.48 g/mol
Exact Mass451.10
IUPAC NameN-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESCS(=O)(=O)Nc1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1F
InChIInChI=1S/C23H18FN3O4S/c1-32(29,30)27-20-13-16(11-12-19(20)24)26-22(28)17-9-5-6-10-18(17)23-25-14-21(31-23)15-7-3-2-4-8-15/h2-14,27H,1H3,(H,26,28)
InChIKeyYDRWTGVVWKRPBD-UHFFFAOYSA-N
XLogP4.77
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.48
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-(3,4-dimethylphenyl)benzamide
CID 100512790
2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide
CID 55836034
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide
CID 36704097
2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-(3,4-dimethylphenyl)benzamide
CID 100509056
2-(5-phenyl-1,3-oxazol-2-yl)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 24676064
N-[4-(ethylsulfonylamino)-3-methoxyphenyl]-2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 55955505
N-(3-chloro-4-cyanophenyl)-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 9456205
2-[5-(3-bromophenyl)-1,3-oxazol-2-yl]-N-(4-chlorophenyl)benzamide
CID 100511057
N-(2-fluorophenyl)-2-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]benzamide
CID 100502310
2-[5-(3-bromophenyl)-1,3-oxazol-2-yl]-N-(2-fluorophenyl)benzamide
CID 100510992
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(4-methoxyphenyl)benzamide
CID 36703629
S-[4-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]phenyl] N,N-dimethylcarbamothioate
CID 56533280

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The IUPAC name of N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (CID 24659708) is N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.
What is the SMILES notation for N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The canonical SMILES for N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is CS(=O)(=O)Nc1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1F.
What is the InChIKey of N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The InChIKey is YDRWTGVVWKRPBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3O4S/c1-32(29,30)27-20-13-16(11-12-19(20)24)26-22(28)17-9-5-6-10-18(17)23-25-14-21(31-23)15-7-3-2-4-8-15/h2-14,27H,1H3,(H,26,28).
What are the key properties of N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide has a molecular weight of 451.48 g/mol, XLogP of 4.77, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is sourced from PubChem (CID 24659708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).