3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol

C26H19NO3 — CID 137183963

IUPAC3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol
SMILESCOc1ccc2cc(O)c(-c3nc(-c4ccccc4)c(-c4ccccc4)o3)cc2c1
InChIInChI=1S/C26H19NO3/c1-29-21-13-12-19-16-23(28)22(15-20(19)14-21)26-27-24(17-8-4-2-5-9-17)25(30-26)18-10-6-3-7-11-18/h2-16,28H,1H3
InChIKeyAMSMVXJERXKLGR-UHFFFAOYSA-N
MW393.44 g/mol
LogP6.54
Rot. Bonds4

About 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol

3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol (PubChem CID 137183963) has the molecular formula C26H19NO3 and a molecular weight of 393.44 g/mol. Its IUPAC name is 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol.

Molecular Properties

Compound Name3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol
PubChem CID137183963
Molecular FormulaC26H19NO3
Molecular Weight393.44 g/mol
Exact Mass393.14
IUPAC Name3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol
SMILESCOc1ccc2cc(O)c(-c3nc(-c4ccccc4)c(-c4ccccc4)o3)cc2c1
InChIInChI=1S/C26H19NO3/c1-29-21-13-12-19-16-23(28)22(15-20(19)14-21)26-27-24(17-8-4-2-5-9-17)25(30-26)18-10-6-3-7-11-18/h2-16,28H,1H3
InChIKeyAMSMVXJERXKLGR-UHFFFAOYSA-N
XLogP6.54
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.44
LogP ≤ 56.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4,5-diphenyl-1,3-oxazol-2-yl)naphthalen-2-ol
CID 136746121
5-(4-chlorophenyl)-4-(4-methoxyphenyl)-2-phenyl-1,3-oxazole
CID 139183533
2-chloro-5-(4-methoxyphenyl)-4-phenyl-1,3-oxazole
CID 54104212
3-[2-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methylphenyl]phenol
CID 12020842
3-(4,5-diphenyl-1,3-oxazol-2-yl)phenol
CID 10470825
2-methoxy-7-(2-phenylphenyl)naphthalene
CID 141340555
2-[4-(4-methoxyphenyl)-2-phenyl-1,3-oxazol-5-yl]benzenesulfonamide
CID 173207529
3-(4,5-diphenyl-1,3-oxazol-2-yl)chromen-2-one
CID 14320030
5-(4-methoxyphenyl)-2,3-diphenylfuran
CID 2733040
6-(4,5-diphenyl-1,3-oxazol-2-yl)naphthalene-2-carboxylic acid
CID 10430529
2-[3-(3-methoxyphenyl)cyclohexen-1-yl]-4,5-diphenyl-1,3-oxazole
CID 21196500
4,5-bis(4-bromophenyl)-2-phenyl-1,3-oxazole
CID 71740991

Frequently Asked Questions

What is the IUPAC name of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol?
The IUPAC name of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol (CID 137183963) is 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol.
What is the SMILES notation for 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol?
The canonical SMILES for 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol is COc1ccc2cc(O)c(-c3nc(-c4ccccc4)c(-c4ccccc4)o3)cc2c1.
What is the InChIKey of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol?
The InChIKey is AMSMVXJERXKLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19NO3/c1-29-21-13-12-19-16-23(28)22(15-20(19)14-21)26-27-24(17-8-4-2-5-9-17)25(30-26)18-10-6-3-7-11-18/h2-16,28H,1H3.
What are the key properties of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol?
3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol has a molecular weight of 393.44 g/mol, XLogP of 6.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-diphenyl-1,3-oxazol-2-yl)-6-methoxynaphthalen-2-ol is sourced from PubChem (CID 137183963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).