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

C11H10ClNO2S — CID 1484575

IUPAC2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole
SMILESCOc1ccc(OCc2cnc(Cl)s2)cc1
InChIInChI=1S/C11H10ClNO2S/c1-14-8-2-4-9(5-3-8)15-7-10-6-13-11(12)16-10/h2-6H,7H2,1H3
InChIKeySSWVKEKMHJNPLP-UHFFFAOYSA-N
MW255.73 g/mol
LogP3.38
Rot. Bonds4

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

2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole (PubChem CID 1484575) has the molecular formula C11H10ClNO2S and a molecular weight of 255.73 g/mol. Its IUPAC name is 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole.

Molecular Properties

Compound Name2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole
PubChem CID1484575
Molecular FormulaC11H10ClNO2S
Molecular Weight255.73 g/mol
Exact Mass255.01
IUPAC Name2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole
SMILESCOc1ccc(OCc2cnc(Cl)s2)cc1
InChIInChI=1S/C11H10ClNO2S/c1-14-8-2-4-9(5-3-8)15-7-10-6-13-11(12)16-10/h2-6H,7H2,1H3
InChIKeySSWVKEKMHJNPLP-UHFFFAOYSA-N
XLogP3.38
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.73
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole?
The IUPAC name of 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole (CID 1484575) is 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole.
What is the SMILES notation for 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole?
The canonical SMILES for 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole is COc1ccc(OCc2cnc(Cl)s2)cc1.
What is the InChIKey of 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole?
The InChIKey is SSWVKEKMHJNPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO2S/c1-14-8-2-4-9(5-3-8)15-7-10-6-13-11(12)16-10/h2-6H,7H2,1H3.
What are the key properties of 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole?
2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole has a molecular weight of 255.73 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[(4-methoxyphenoxy)methyl]-1,3-thiazole is sourced from PubChem (CID 1484575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).