methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate

C18H16N2O5S — CID 67623640

IUPACmethyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate
SMILESCOC(=O)Cc1nc(-c2ccccc2S(N)(=O)=O)c(-c2ccccc2)o1
InChIInChI=1S/C18H16N2O5S/c1-24-16(21)11-15-20-17(18(25-15)12-7-3-2-4-8-12)13-9-5-6-10-14(13)26(19,22)23/h2-10H,11H2,1H3,(H2,19,22,23)
InChIKeyONMIAMOYWVYJII-UHFFFAOYSA-N
MW372.40 g/mol
LogP2.37
Rot. Bonds5

About methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate

methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate (PubChem CID 67623640) has the molecular formula C18H16N2O5S and a molecular weight of 372.40 g/mol. Its IUPAC name is methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate
PubChem CID67623640
Molecular FormulaC18H16N2O5S
Molecular Weight372.40 g/mol
Exact Mass372.08
IUPAC Namemethyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate
SMILESCOC(=O)Cc1nc(-c2ccccc2S(N)(=O)=O)c(-c2ccccc2)o1
InChIInChI=1S/C18H16N2O5S/c1-24-16(21)11-15-20-17(18(25-15)12-7-3-2-4-8-12)13-9-5-6-10-14(13)26(19,22)23/h2-10H,11H2,1H3,(H2,19,22,23)
InChIKeyONMIAMOYWVYJII-UHFFFAOYSA-N
XLogP2.37
TPSA112.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.40
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 3-[4-phenyl-5-(4-sulfamoylphenyl)-1,3-oxazol-2-yl]propanoate
CID 11948196
ethyl 2-(4,5-diphenyl-1,3-oxazol-2-yl)acetate
CID 14971801
2-[2-benzyl-5-(3-methylphenyl)-1,3-oxazol-4-yl]benzenesulfonamide
CID 67624965
4-[5-(4-chlorophenyl)-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]-N-hydroxybutanamide
CID 22505162
2-[2-(phenoxymethyl)-4-phenyl-1,3-oxazol-5-yl]benzenesulfonamide
CID 67622817
methyl 2-[5-(3-chloro-4-fluorophenyl)-4-(4-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate
CID 11947914
2-[4-(4-chlorophenyl)-5-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]-N-hydroxy-N-methylacetamide
CID 87974449
N-hydroxy-N-methyl-4-[4-phenyl-5-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]butanamide
CID 22505284
3-[4-[[4-phenyl-5-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]methyl]phenyl]propanoic acid
CID 67771808
N-hydroxy-3-[4-(4-methoxyphenyl)-5-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]-N-methylpropanamide
CID 22505474
3-[[4-phenyl-5-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]methoxy]benzoic acid
CID 67622923
2-[2-benzyl-5-(2-fluoro-6-methylphenyl)-1,3-oxazol-4-yl]benzenesulfonamide
CID 67625216

Frequently Asked Questions

What is the IUPAC name of methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate?
The IUPAC name of methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate (CID 67623640) is methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate.
What is the SMILES notation for methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate?
The canonical SMILES for methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate is COC(=O)Cc1nc(-c2ccccc2S(N)(=O)=O)c(-c2ccccc2)o1.
What is the InChIKey of methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate?
The InChIKey is ONMIAMOYWVYJII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O5S/c1-24-16(21)11-15-20-17(18(25-15)12-7-3-2-4-8-12)13-9-5-6-10-14(13)26(19,22)23/h2-10H,11H2,1H3,(H2,19,22,23).
What are the key properties of methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate?
methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate has a molecular weight of 372.40 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[5-phenyl-4-(2-sulfamoylphenyl)-1,3-oxazol-2-yl]acetate is sourced from PubChem (CID 67623640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).