3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole

C19H19NO5 — CID 19586357

IUPAC3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole
SMILESCOc1ccc(-c2cc(-c3ccc(OC)cc3OC)on2)c(OC)c1
InChIInChI=1S/C19H19NO5/c1-21-12-5-7-14(17(9-12)23-3)16-11-19(25-20-16)15-8-6-13(22-2)10-18(15)24-4/h5-11H,1-4H3
InChIKeyDQZAUGRSNUPRES-UHFFFAOYSA-N
MW341.36 g/mol
LogP4.04
Rot. Bonds6

About 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole

3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole (PubChem CID 19586357) has the molecular formula C19H19NO5 and a molecular weight of 341.36 g/mol. Its IUPAC name is 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole.

Molecular Properties

Compound Name3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole
PubChem CID19586357
Molecular FormulaC19H19NO5
Molecular Weight341.36 g/mol
Exact Mass341.13
IUPAC Name3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole
SMILESCOc1ccc(-c2cc(-c3ccc(OC)cc3OC)on2)c(OC)c1
InChIInChI=1S/C19H19NO5/c1-21-12-5-7-14(17(9-12)23-3)16-11-19(25-20-16)15-8-6-13(22-2)10-18(15)24-4/h5-11H,1-4H3
InChIKeyDQZAUGRSNUPRES-UHFFFAOYSA-N
XLogP4.04
TPSA62.95 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.36
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2,4-dimethoxyphenyl)-1,2-oxazole-3-carboxylic acid
CID 16792916
[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]azanide
CID 161351760
3-(2,5-dimethoxyphenyl)-5-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1,2-oxazole
CID 155811921
4-(2,4-dimethoxyphenyl)-2-pyridin-4-yl-1,3-thiazole
CID 23408094
[(Z)-[[4-[3-[4-[(Z)-N'-acetyloxycarbamimidoyl]-2-methoxyphenyl]-1,2-oxazol-5-yl]-3-methoxyphenyl]-aminomethylidene]amino] acetate
CID 11990740
3,5-bis(4-methoxyphenyl)-1,2-oxazole
CID 10956920
5-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-amine
CID 63691181
2-[5-(2,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]propan-2-amine
CID 61325495
3-(4-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-1,2-oxazole
CID 91309550
3-(2,4-dimethoxyphenyl)pyridazine
CID 90984808
1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
N-cyclopropyl-N-[[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
CID 51070076

Frequently Asked Questions

What is the IUPAC name of 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole?
The IUPAC name of 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole (CID 19586357) is 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole.
What is the SMILES notation for 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole?
The canonical SMILES for 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole is COc1ccc(-c2cc(-c3ccc(OC)cc3OC)on2)c(OC)c1.
What is the InChIKey of 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole?
The InChIKey is DQZAUGRSNUPRES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO5/c1-21-12-5-7-14(17(9-12)23-3)16-11-19(25-20-16)15-8-6-13(22-2)10-18(15)24-4/h5-11H,1-4H3.
What are the key properties of 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole?
3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole has a molecular weight of 341.36 g/mol, XLogP of 4.04, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis(2,4-dimethoxyphenyl)-1,2-oxazole is sourced from PubChem (CID 19586357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).