[4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone

C16H10ClNO2 — CID 175076754

IUPAC[4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(Cl)c(-c2ccon2)c1
InChIInChI=1S/C16H10ClNO2/c17-14-7-6-12(10-13(14)15-8-9-20-18-15)16(19)11-4-2-1-3-5-11/h1-10H
InChIKeyXKNYVQRJJMRUNC-UHFFFAOYSA-N
MW283.71 g/mol
LogP4.23
Rot. Bonds3

About [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone

[4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone (PubChem CID 175076754) has the molecular formula C16H10ClNO2 and a molecular weight of 283.71 g/mol. Its IUPAC name is [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone
PubChem CID175076754
Molecular FormulaC16H10ClNO2
Molecular Weight283.71 g/mol
Exact Mass283.04
IUPAC Name[4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone
SMILESO=C(c1ccccc1)c1ccc(Cl)c(-c2ccon2)c1
InChIInChI=1S/C16H10ClNO2/c17-14-7-6-12(10-13(14)15-8-9-20-18-15)16(19)11-4-2-1-3-5-11/h1-10H
InChIKeyXKNYVQRJJMRUNC-UHFFFAOYSA-N
XLogP4.23
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.71
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-benzoyl-4-chlorophenyl)-(4-chlorophenyl)methanone
CID 18951954
[3,4-bis(trimethylsilyl)phenyl]-phenylmethanone
CID 11609549
1-(4-chloro-3-pyridin-2-ylphenyl)-2,2-dimethylpropan-1-one
CID 71105825
naphthalen-2-yl(phenyl)(113C)methanone
CID 101359138
diphenylmethanone
CID 3102
carbamic acid;3-phenyl-1,2-oxazole
CID 175520433
CID 172605119
CID 172605119
4-[3-(4-carboxybenzoyl)benzoyl]benzoic acid
CID 22561490
(4-chlorophenyl)-phenylmethanone dichloride
CID 22505815
N-(5-benzoyl-2-chlorophenyl)-3-oxobutanamide
CID 154130409
(3,4-dichlorophenyl)-(3-hydroxyphenyl)methanone
CID 12639783
[3,4-bis(4-fluorophenyl)phenyl]-phenylmethanone
CID 46188813

Frequently Asked Questions

What is the IUPAC name of [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone?
The IUPAC name of [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone (CID 175076754) is [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone.
What is the SMILES notation for [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone?
The canonical SMILES for [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone is O=C(c1ccccc1)c1ccc(Cl)c(-c2ccon2)c1.
What is the InChIKey of [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone?
The InChIKey is XKNYVQRJJMRUNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClNO2/c17-14-7-6-12(10-13(14)15-8-9-20-18-15)16(19)11-4-2-1-3-5-11/h1-10H.
What are the key properties of [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone?
[4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone has a molecular weight of 283.71 g/mol, XLogP of 4.23, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-3-(1,2-oxazol-3-yl)phenyl]-phenylmethanone is sourced from PubChem (CID 175076754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).