N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide

C19H19N3O5S — CID 1484365

IUPACN-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide
SMILESCOc1ccc(-c2cc(CNS(=O)(=O)c3ccc(NC(C)=O)cc3)on2)cc1
InChIInChI=1S/C19H19N3O5S/c1-13(23)21-15-5-9-18(10-6-15)28(24,25)20-12-17-11-19(22-27-17)14-3-7-16(26-2)8-4-14/h3-11,20H,12H2,1-2H3,(H,21,23)
InChIKeyOIJZNZSWYQOBAI-UHFFFAOYSA-N
MW401.44 g/mol
LogP2.79
Rot. Bonds7

About N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide

N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide (PubChem CID 1484365) has the molecular formula C19H19N3O5S and a molecular weight of 401.44 g/mol. Its IUPAC name is N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide
PubChem CID1484365
Molecular FormulaC19H19N3O5S
Molecular Weight401.44 g/mol
Exact Mass401.10
IUPAC NameN-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide
SMILESCOc1ccc(-c2cc(CNS(=O)(=O)c3ccc(NC(C)=O)cc3)on2)cc1
InChIInChI=1S/C19H19N3O5S/c1-13(23)21-15-5-9-18(10-6-15)28(24,25)20-12-17-11-19(22-27-17)14-3-7-16(26-2)8-4-14/h3-11,20H,12H2,1-2H3,(H,21,23)
InChIKeyOIJZNZSWYQOBAI-UHFFFAOYSA-N
XLogP2.79
TPSA110.53 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.44
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(3,4-Dimethyl-isoxazol-5-ylsulfamoyl)-phenyl]-3,4-dimethoxy-benzamide
CID 648989
N-[4-(3,4-Dimethyl-isoxazol-5-ylsulfamoyl)-phenyl]-4-methoxy-benzamide
CID 655804
N-(4-(N-(3,4-dimethylisoxazol-5-yl)sulfamoyl)phenyl)-3-methoxybenzamide
CID 978533
2-[N-(4-Methoxyphenyl)3,5-dimethyl-1,2-oxazole-4-sulfonamido]-N-[(4-methylphenyl)methyl]acetamide
CID 20858863
(E)-3-(3,4-dimethoxyphenyl)-N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]prop-2-enamide
CID 1012003
N-{4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl}-2-[4-(propan-2-yl)phenoxy]acetamide
CID 985941
N-{[3-(4-methoxyphenyl)-5-isoxazolyl]methyl}benzenesulfonamide
CID 1480806
N-[4-(3,4-Dimethyl-isoxazol-5-ylsulfamoyl)-phenyl]-4-m-tolyloxy-butyramide
CID 649495
N-[4-(5-Methyl-isoxazol-3-ylsulfamoyl)-phenyl]-4-p-tolyloxy-butyramide
CID 652041
2-methoxy-N-(4-{[(5-methyl-3-isoxazolyl)amino]sulfonyl}phenyl)benzamide
CID 1093076
N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-2-(4-ethylphenoxy)acetamide
CID 1107619
2-(4-methoxyphenyl)-N-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]acetamide
CID 1154224

Frequently Asked Questions

What is the IUPAC name of N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide (CID 1484365) is N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide is COc1ccc(-c2cc(CNS(=O)(=O)c3ccc(NC(C)=O)cc3)on2)cc1.
What is the InChIKey of N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide?
The InChIKey is OIJZNZSWYQOBAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O5S/c1-13(23)21-15-5-9-18(10-6-15)28(24,25)20-12-17-11-19(22-27-17)14-3-7-16(26-2)8-4-14/h3-11,20H,12H2,1-2H3,(H,21,23).
What are the key properties of N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide?
N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide has a molecular weight of 401.44 g/mol, XLogP of 2.79, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfamoyl]phenyl]acetamide is sourced from PubChem (CID 1484365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).