2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole

C10H6ClF2NOS — CID 79764988

IUPAC2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole
SMILESFc1ccc(OCc2cnc(Cl)s2)c(F)c1
InChIInChI=1S/C10H6ClF2NOS/c11-10-14-4-7(16-10)5-15-9-2-1-6(12)3-8(9)13/h1-4H,5H2
InChIKeyFLOFVWIGTNYPJV-UHFFFAOYSA-N
MW261.68 g/mol
LogP3.65
Rot. Bonds3

About 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole

2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole (PubChem CID 79764988) has the molecular formula C10H6ClF2NOS and a molecular weight of 261.68 g/mol. Its IUPAC name is 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole.

Molecular Properties

Compound Name2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole
PubChem CID79764988
Molecular FormulaC10H6ClF2NOS
Molecular Weight261.68 g/mol
Exact Mass260.98
IUPAC Name2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole
SMILESFc1ccc(OCc2cnc(Cl)s2)c(F)c1
InChIInChI=1S/C10H6ClF2NOS/c11-10-14-4-7(16-10)5-15-9-2-1-6(12)3-8(9)13/h1-4H,5H2
InChIKeyFLOFVWIGTNYPJV-UHFFFAOYSA-N
XLogP3.65
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.68
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2-bromo-5-fluorophenoxy)methyl]-2-chloro-1,3-thiazole
CID 81496091
2-[(2-chloro-1,3-thiazol-5-yl)methoxy]-6-fluorobenzonitrile
CID 79764862
2-chloro-5-[(2,5-dimethylphenoxy)methyl]-1,3-thiazole
CID 79764612
2-chloro-4-[(2,4-difluorophenoxy)methyl]pyridine
CID 62045301
2-[5-fluoro-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanamine
CID 107700166
2-(chloromethyl)-5-[(2,4-difluorophenoxy)methyl]-1,3,4-oxadiazole
CID 39360983
2-chloro-5-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazole
CID 79765645
N-[(2-chloro-1,3-thiazol-5-yl)methyl]-2-(difluoromethoxy)-5-fluoroaniline
CID 168581269
N-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-(2,4-difluorophenoxy)-5-nitroaniline
CID 168581898
N-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-fluoro-2-[(2-methylpyrazol-3-yl)methoxy]aniline
CID 168583285
[5-[(2-bromo-4-fluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 79764417
2-(4-chlorophenyl)-5-[(2,4-difluorophenoxy)methyl]-1,3,4-oxadiazole
CID 110655751

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole?
The IUPAC name of 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole (CID 79764988) is 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole.
What is the SMILES notation for 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole?
The canonical SMILES for 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole is Fc1ccc(OCc2cnc(Cl)s2)c(F)c1.
What is the InChIKey of 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole?
The InChIKey is FLOFVWIGTNYPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClF2NOS/c11-10-14-4-7(16-10)5-15-9-2-1-6(12)3-8(9)13/h1-4H,5H2.
What are the key properties of 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole?
2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole has a molecular weight of 261.68 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[(2,4-difluorophenoxy)methyl]-1,3-thiazole is sourced from PubChem (CID 79764988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).