2-chloro-5-(3-methoxyphenyl)-1,3-thiazole

C10H8ClNOS — CID 117259772

IUPAC2-chloro-5-(3-methoxyphenyl)-1,3-thiazole
SMILESCOc1cccc(-c2cnc(Cl)s2)c1
InChIInChI=1S/C10H8ClNOS/c1-13-8-4-2-3-7(5-8)9-6-12-10(11)14-9/h2-6H,1H3
InChIKeyJZCLXBPNELLJMB-UHFFFAOYSA-N
MW225.70 g/mol
LogP3.47
Rot. Bonds2

About 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole

2-chloro-5-(3-methoxyphenyl)-1,3-thiazole (PubChem CID 117259772) has the molecular formula C10H8ClNOS and a molecular weight of 225.70 g/mol. Its IUPAC name is 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole.

Molecular Properties

Compound Name2-chloro-5-(3-methoxyphenyl)-1,3-thiazole
PubChem CID117259772
Molecular FormulaC10H8ClNOS
Molecular Weight225.70 g/mol
Exact Mass225.00
IUPAC Name2-chloro-5-(3-methoxyphenyl)-1,3-thiazole
SMILESCOc1cccc(-c2cnc(Cl)s2)c1
InChIInChI=1S/C10H8ClNOS/c1-13-8-4-2-3-7(5-8)9-6-12-10(11)14-9/h2-6H,1H3
InChIKeyJZCLXBPNELLJMB-UHFFFAOYSA-N
XLogP3.47
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.70
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-5-[4-(4-methoxyphenyl)phenyl]-1,3-thiazole
CID 21408740
5-(3-methoxyphenyl)-1,3-thiazole-2-carboxylic acid
CID 46785031
1-[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 46785061
2-chloro-5-[(3-methoxyphenoxy)methyl]-1,3-thiazole
CID 79764226
N-[[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]methyl]-1-phenylmethanamine
CID 53272362
2-(2,4-dichlorophenyl)-N-[[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]methyl]ethanamine
CID 53272468
4-chloro-6-(3-methoxyphenyl)thieno[3,2-d]pyrimidine
CID 43332773
N-[[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]methyl]cyclopentanamine
CID 53272487
5-(chloromethyl)-2-(3-methoxyphenyl)-1,3-thiazole;hydrochloride
CID 54759132
2-chloro-4-(3-methoxyphenyl)-5-propan-2-yl-1,3-thiazole
CID 160973028
3,6-dibromo-4-[5-(3-methoxyphenyl)-1,3-thiazol-2-yl]benzene-1,2-diol
CID 135453484
2-chloro-5-(3-methoxyphenyl)-4-phenyl-1,3-thiazole
CID 54307577

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole?
The IUPAC name of 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole (CID 117259772) is 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole.
What is the SMILES notation for 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole?
The canonical SMILES for 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole is COc1cccc(-c2cnc(Cl)s2)c1.
What is the InChIKey of 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole?
The InChIKey is JZCLXBPNELLJMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNOS/c1-13-8-4-2-3-7(5-8)9-6-12-10(11)14-9/h2-6H,1H3.
What are the key properties of 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole?
2-chloro-5-(3-methoxyphenyl)-1,3-thiazole has a molecular weight of 225.70 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(3-methoxyphenyl)-1,3-thiazole is sourced from PubChem (CID 117259772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).