2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole

C16H11F2NOS — CID 71459804

IUPAC2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole
SMILESCOc1cccc(-c2csc(-c3cccc(F)c3F)n2)c1
InChIInChI=1S/C16H11F2NOS/c1-20-11-5-2-4-10(8-11)14-9-21-16(19-14)12-6-3-7-13(17)15(12)18/h2-9H,1H3
InChIKeyOWBYDQBRBGFHHU-UHFFFAOYSA-N
MW303.33 g/mol
LogP4.76
Rot. Bonds3

About 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole

2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole (PubChem CID 71459804) has the molecular formula C16H11F2NOS and a molecular weight of 303.33 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole
PubChem CID71459804
Molecular FormulaC16H11F2NOS
Molecular Weight303.33 g/mol
Exact Mass303.05
IUPAC Name2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole
SMILESCOc1cccc(-c2csc(-c3cccc(F)c3F)n2)c1
InChIInChI=1S/C16H11F2NOS/c1-20-11-5-2-4-10(8-11)14-9-21-16(19-14)12-6-3-7-13(17)15(12)18/h2-9H,1H3
InChIKeyOWBYDQBRBGFHHU-UHFFFAOYSA-N
XLogP4.76
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Itazigrel
CID 51087
4-(Chloromethyl)-2-(3-methoxyphenyl)-1,3-thiazole hydrochloride
CID 16196167
Sodium 2-[2-(3-phenoxyphenyl)-1,3-thiazol-4-yl]acetate
CID 23672769
3-[2-(3-Hydroxyphenyl)-1,3-thiazol-4-yl]phenol
CID 25093377
4-(4-(4-Methoxyphenyl)thiazol-2-yl)phenol
CID 829532
4-[3-(Trifluoromethoxy)phenyl]-1,3-thiazol-2-amine
CID 2760731
4-(3-Methoxyphenyl)-1,3-thiazol-2-amine
CID 734629
2-(Fluoromethyl)4-(2-(3-methoxyphenyl)ethynyl)thiazole
CID 16737209
4-(2,4-Dimethoxyphenyl)-2-phenyl-1,3-thiazole
CID 2441960
4-(3,4-Difluorophenyl)-2-[(4-methoxyphenoxy)methyl]-1,3-thiazole
CID 2742375
4-(4-Methoxy-phenyl)-2-(2-methyl-tetrahydro-pyran-4-yl)-thiazole
CID 16682543
4-[4-(3-Methoxy-phenyl)-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxamidine
CID 9822176

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole?
The IUPAC name of 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole (CID 71459804) is 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole.
What is the SMILES notation for 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole?
The canonical SMILES for 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole is COc1cccc(-c2csc(-c3cccc(F)c3F)n2)c1.
What is the InChIKey of 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole?
The InChIKey is OWBYDQBRBGFHHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2NOS/c1-20-11-5-2-4-10(8-11)14-9-21-16(19-14)12-6-3-7-13(17)15(12)18/h2-9H,1H3.
What are the key properties of 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole?
2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole has a molecular weight of 303.33 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-4-(3-methoxyphenyl)-1,3-thiazole is sourced from PubChem (CID 71459804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).