(5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate

C24H19NO4 — CID 16500406

IUPAC(5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate
SMILESO=C(OCc1ncc(-c2ccccc2)o1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H19NO4/c26-23(28-17-22-25-16-21(29-22)18-10-4-1-5-11-18)24(27,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-16,27H,17H2
InChIKeyMQUOSZNFHWGYQZ-UHFFFAOYSA-N
MW385.42 g/mol
LogP4.32
Rot. Bonds6

About (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate

(5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate (PubChem CID 16500406) has the molecular formula C24H19NO4 and a molecular weight of 385.42 g/mol. Its IUPAC name is (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate.

Molecular Properties

Compound Name(5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate
PubChem CID16500406
Molecular FormulaC24H19NO4
Molecular Weight385.42 g/mol
Exact Mass385.13
IUPAC Name(5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate
SMILESO=C(OCc1ncc(-c2ccccc2)o1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H19NO4/c26-23(28-17-22-25-16-21(29-22)18-10-4-1-5-11-18)24(27,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-16,27H,17H2
InChIKeyMQUOSZNFHWGYQZ-UHFFFAOYSA-N
XLogP4.32
TPSA72.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 2-hydroxy-2-methyl-3-phenylbutanoate
CID 75424220
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(5-phenyl-1,3-oxazol-2-yl)methyl (2S)-2-phenylbutanoate
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(5-phenyl-1,3-oxazol-2-yl)methyl 3-hydroxybenzoate
CID 7790163
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(5-phenyl-1,3-oxazol-2-yl)methyl 2-methylfuran-3-carboxylate
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(5-phenyl-1,3-oxazol-2-yl)methyl 3-iodobenzoate
CID 8011127
(5-phenyl-1,3-oxazol-2-yl)methyl (1S)-2,2-dichloro-1-methylcyclopropane-1-carboxylate
CID 9454592
(5-phenyl-1,3-oxazol-2-yl)methyl 2,5-dimethylfuran-3-carboxylate
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(5-phenyl-1,3-oxazol-2-yl)methyl 3-phenoxybenzoate
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CID 47028405

Frequently Asked Questions

What is the IUPAC name of (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate?
The IUPAC name of (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate (CID 16500406) is (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate.
What is the SMILES notation for (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate?
The canonical SMILES for (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate is O=C(OCc1ncc(-c2ccccc2)o1)C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate?
The InChIKey is MQUOSZNFHWGYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO4/c26-23(28-17-22-25-16-21(29-22)18-10-4-1-5-11-18)24(27,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-16,27H,17H2.
What are the key properties of (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate?
(5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate has a molecular weight of 385.42 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-phenyl-1,3-oxazol-2-yl)methyl 2-hydroxy-2,2-diphenylacetate is sourced from PubChem (CID 16500406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).