5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide

C17H12Cl2N2O3 — CID 46696629

IUPAC5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide
SMILESNC(=O)c1cc(Cl)ccc1OCc1cc(-c2ccc(Cl)cc2)no1
InChIInChI=1S/C17H12Cl2N2O3/c18-11-3-1-10(2-4-11)15-8-13(24-21-15)9-23-16-6-5-12(19)7-14(16)17(20)22/h1-8H,9H2,(H2,20,22)
InChIKeyCSOSOMWDJBDVLU-UHFFFAOYSA-N
MW363.20 g/mol
LogP4.33
Rot. Bonds5

About 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide

5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide (PubChem CID 46696629) has the molecular formula C17H12Cl2N2O3 and a molecular weight of 363.20 g/mol. Its IUPAC name is 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide.

Molecular Properties

Compound Name5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide
PubChem CID46696629
Molecular FormulaC17H12Cl2N2O3
Molecular Weight363.20 g/mol
Exact Mass362.02
IUPAC Name5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide
SMILESNC(=O)c1cc(Cl)ccc1OCc1cc(-c2ccc(Cl)cc2)no1
InChIInChI=1S/C17H12Cl2N2O3/c18-11-3-1-10(2-4-11)15-8-13(24-21-15)9-23-16-6-5-12(19)7-14(16)17(20)22/h1-8H,9H2,(H2,20,22)
InChIKeyCSOSOMWDJBDVLU-UHFFFAOYSA-N
XLogP4.33
TPSA78.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.20
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(2-chlorophenoxy)methyl]-3-(4-chlorophenyl)-1,2-oxazole
CID 146097170
5-[(4-chloro-2-methylphenoxy)methyl]-3-phenyl-1,2-oxazole
CID 1484373
3-(4-chlorophenyl)-5-[(4-methylphenoxy)methyl]-1,2-oxazole
CID 118321395
methyl 2-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]acetate
CID 131857629
[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 6-(trifluoromethyl)pyridine-3-carboxylate
CID 138465127
2-[(3-phenyl-1,2-oxazol-5-yl)methoxy]aniline
CID 61027686
2-(azetidin-3-ylmethoxy)-5-chlorobenzamide
CID 71133700
2-[(5-bromofuran-2-yl)methoxy]-5-chlorobenzoic acid
CID 61379285
5-[(2-chloro-4-fluorophenoxy)methyl]-3-phenyl-1,2-oxazole
CID 134010105
[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 4-oxo-3-phenylphthalazine-1-carboxylate
CID 46696668
[3-[4-[(3,4-difluorophenyl)methoxy]phenyl]-1,2-oxazol-5-yl]methyl carbamate
CID 46892622
[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl carbamate
CID 46892996

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide?
The IUPAC name of 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide (CID 46696629) is 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide.
What is the SMILES notation for 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide?
The canonical SMILES for 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide is NC(=O)c1cc(Cl)ccc1OCc1cc(-c2ccc(Cl)cc2)no1.
What is the InChIKey of 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide?
The InChIKey is CSOSOMWDJBDVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O3/c18-11-3-1-10(2-4-11)15-8-13(24-21-15)9-23-16-6-5-12(19)7-14(16)17(20)22/h1-8H,9H2,(H2,20,22).
What are the key properties of 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide?
5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide has a molecular weight of 363.20 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methoxy]benzamide is sourced from PubChem (CID 46696629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).