2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole

C19H19NO4S — CID 159796294

IUPAC2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole
SMILESCOc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)c(OC)c1
InChIInChI=1S/C19H19NO4S/c1-21-12-5-7-14(17(9-12)23-3)16-11-25-19(20-16)15-8-6-13(22-2)10-18(15)24-4/h5-11H,1-4H3
InChIKeyYXHUKYMJGBZBNB-UHFFFAOYSA-N
MW357.43 g/mol
LogP4.51
Rot. Bonds6

About 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole

2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole (PubChem CID 159796294) has the molecular formula C19H19NO4S and a molecular weight of 357.43 g/mol. Its IUPAC name is 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole.

Molecular Properties

Compound Name2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole
PubChem CID159796294
Molecular FormulaC19H19NO4S
Molecular Weight357.43 g/mol
Exact Mass357.10
IUPAC Name2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole
SMILESCOc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)c(OC)c1
InChIInChI=1S/C19H19NO4S/c1-21-12-5-7-14(17(9-12)23-3)16-11-25-19(20-16)15-8-6-13(22-2)10-18(15)24-4/h5-11H,1-4H3
InChIKeyYXHUKYMJGBZBNB-UHFFFAOYSA-N
XLogP4.51
TPSA49.81 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[3-Acetyloxy-5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]phenyl] acetate
CID 11744022
4-(4-(4-Methoxyphenyl)thiazol-2-yl)phenol
CID 829532
4-(2,4-Dimethoxyphenyl)-2-phenyl-1,3-thiazole
CID 2441960
4-(2,4-Dimethoxyphenyl)-2-thiophen-2-yl-1,3-thiazole
CID 2468633
N-cyclohexyl-4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-amine
CID 2620735
4-(4-Methoxy-phenyl)-2-(2-methyl-tetrahydro-pyran-4-yl)-thiazole
CID 16682543
4-[2-(3,4-Dimethoxyphenyl)thiazol-4-yl]benzene-1,3-diol
CID 787560
4-[4-(2,4-Dimethoxy-phenyl)-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxamidine
CID 18537468
4-(3-Methoxyphenyl)-2-phenyl-1,3-thiazole
CID 18731901
2,4-Bis(3-Methoxyphenyl)Thiazole
CID 24431784
(3,5-Dimethoxyphenyl)(2-phenyl-4-thiazolyl)methanone
CID 25258606
[(2-Phenyl-1,3-thiazol-4-yl)-(3,4,5-trimethoxyphenyl)methylidene]cyanamide
CID 53361673

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole?
The IUPAC name of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole (CID 159796294) is 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole.
What is the SMILES notation for 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole?
The canonical SMILES for 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole is COc1ccc(-c2csc(-c3ccc(OC)cc3OC)n2)c(OC)c1.
What is the InChIKey of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole?
The InChIKey is YXHUKYMJGBZBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO4S/c1-21-12-5-7-14(17(9-12)23-3)16-11-25-19(20-16)15-8-6-13(22-2)10-18(15)24-4/h5-11H,1-4H3.
What are the key properties of 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole?
2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole has a molecular weight of 357.43 g/mol, XLogP of 4.51, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(2,4-dimethoxyphenyl)-1,3-thiazole is sourced from PubChem (CID 159796294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).