5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol

C24H21NO4 — CID 142932039

IUPAC5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol
SMILESCOc1ccc(-c2c(C)noc2-c2cc(-c3ccccc3)c(OC)cc2O)cc1
InChIInChI=1S/C24H21NO4/c1-15-23(17-9-11-18(27-2)12-10-17)24(29-25-15)20-13-19(16-7-5-4-6-8-16)22(28-3)14-21(20)26/h4-14,26H,1-3H3
InChIKeyHKSDOESRVQTEAJ-UHFFFAOYSA-N
MW387.44 g/mol
LogP5.71
Rot. Bonds5

About 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol

5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol (PubChem CID 142932039) has the molecular formula C24H21NO4 and a molecular weight of 387.44 g/mol. Its IUPAC name is 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol.

Molecular Properties

Compound Name5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol
PubChem CID142932039
Molecular FormulaC24H21NO4
Molecular Weight387.44 g/mol
Exact Mass387.15
IUPAC Name5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol
SMILESCOc1ccc(-c2c(C)noc2-c2cc(-c3ccccc3)c(OC)cc2O)cc1
InChIInChI=1S/C24H21NO4/c1-15-23(17-9-11-18(27-2)12-10-17)24(29-25-15)20-13-19(16-7-5-4-6-8-16)22(28-3)14-21(20)26/h4-14,26H,1-3H3
InChIKeyHKSDOESRVQTEAJ-UHFFFAOYSA-N
XLogP5.71
TPSA64.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.44
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-ethyl-5-methoxy-2-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenol
CID 854607
4-chloro-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
CID 143777991
[3-hydroxy-4-(3-methyl-4-phenyl-1,2-oxazol-5-yl)phenyl]oxidanium
CID 155722733
2-[3-amino-4-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4-ethyl-5-methoxyphenol
CID 952905
4-[4-(3,4-dimethoxyphenyl)-3-methyl-1,2-oxazol-5-yl]benzene-1,3-diol
CID 135650271
5-[5-bromo-2,4-bis(phenylmethoxy)phenyl]-4-(4-methoxyphenyl)-3-methyl-1,2-oxazole;methyl 2,4-dihydroxy-5-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]benzoate;methyl 5-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-2,4-bis(phenylmethoxy)benzoate
CID 161462431
4-[4-[6-(4-methoxyphenyl)-2-phenylpyrimidin-4-yl]phenyl]-3,5-dimethyl-1,2-oxazole
CID 118721631
5-methoxy-2-(4-phenyl-1,2-oxazol-5-yl)phenol
CID 135657525
3,4-dimethoxy-2-(4-methoxyphenyl)-5-phenylphenol
CID 139590135
ethane;6-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-methylcyclohepta-1,3,5-triene-1,3-diol
CID 142932008
4-chloro-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol;N-methylhydroxylamine;N-(8-oxooctyl)formamide
CID 143777990
5-[(4-fluorophenyl)methoxy]-2-[4-(2-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]phenol
CID 135652684

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol?
The IUPAC name of 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol (CID 142932039) is 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol.
What is the SMILES notation for 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol?
The canonical SMILES for 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol is COc1ccc(-c2c(C)noc2-c2cc(-c3ccccc3)c(OC)cc2O)cc1.
What is the InChIKey of 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol?
The InChIKey is HKSDOESRVQTEAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NO4/c1-15-23(17-9-11-18(27-2)12-10-17)24(29-25-15)20-13-19(16-7-5-4-6-8-16)22(28-3)14-21(20)26/h4-14,26H,1-3H3.
What are the key properties of 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol?
5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol has a molecular weight of 387.44 g/mol, XLogP of 5.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-[4-(4-methoxyphenyl)-3-methyl-1,2-oxazol-5-yl]-4-phenylphenol is sourced from PubChem (CID 142932039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).