4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole

C22H18N2O2S — CID 15076241

IUPAC4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole
SMILESCOc1ccc(-c2nc(-c3ccccn3)sc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C22H18N2O2S/c1-25-17-10-6-15(7-11-17)20-21(16-8-12-18(26-2)13-9-16)27-22(24-20)19-5-3-4-14-23-19/h3-14H,1-2H3
InChIKeyFIMFXNFDETVEMR-UHFFFAOYSA-N
MW374.47 g/mol
LogP5.56
Rot. Bonds5

About 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole

4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole (PubChem CID 15076241) has the molecular formula C22H18N2O2S and a molecular weight of 374.47 g/mol. Its IUPAC name is 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole.

Molecular Properties

Compound Name4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole
PubChem CID15076241
Molecular FormulaC22H18N2O2S
Molecular Weight374.47 g/mol
Exact Mass374.11
IUPAC Name4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole
SMILESCOc1ccc(-c2nc(-c3ccccn3)sc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C22H18N2O2S/c1-25-17-10-6-15(7-11-17)20-21(16-8-12-18(26-2)13-9-16)27-22(24-20)19-5-3-4-14-23-19/h3-14H,1-2H3
InChIKeyFIMFXNFDETVEMR-UHFFFAOYSA-N
XLogP5.56
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.47
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(4-methoxyphenyl)thiophen-2-yl]pyridine
CID 59693441
4-(4-methoxy-2-pyridin-2-yl-1,3-thiazol-5-yl)-N,N-diphenylaniline
CID 70677721
4-[4-(difluoromethoxy)phenyl]-5-methyl-2-pyridin-2-yl-1,3-thiazole
CID 8964182
4-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)aniline
CID 116885261
4-(4-chlorophenyl)-5-methyl-2-pyridin-2-yl-1,3-thiazole
CID 4822801
4-[3-(4-methoxyphenyl)phenyl]-2,6-dipyridin-2-ylpyridine
CID 86064133
5,8-bis[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-2,3-bis(4-methoxyphenyl)quinoxaline
CID 170556563
4-[4-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-5-methoxyphenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122221010
4-(4-methoxyphenyl)-5-(4-phenylphenyl)-1,3-thiazol-2-amine
CID 88568617
10-[4-(4-methoxy-2-pyridin-2-yl-1,3-thiazol-5-yl)phenyl]phenoxazine
CID 70677861
2-[2-(4-methoxyphenyl)cyclohexen-1-yl]pyridine
CID 102382394
4-(4-aminophenyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid
CID 82227073

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole?
The IUPAC name of 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole (CID 15076241) is 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole.
What is the SMILES notation for 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole?
The canonical SMILES for 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole is COc1ccc(-c2nc(-c3ccccn3)sc2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole?
The InChIKey is FIMFXNFDETVEMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O2S/c1-25-17-10-6-15(7-11-17)20-21(16-8-12-18(26-2)13-9-16)27-22(24-20)19-5-3-4-14-23-19/h3-14H,1-2H3.
What are the key properties of 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole?
4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole has a molecular weight of 374.47 g/mol, XLogP of 5.56, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(4-methoxyphenyl)-2-pyridin-2-yl-1,3-thiazole is sourced from PubChem (CID 15076241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).