4-chloro-2-methoxy-1,3-thiazole

C4H4ClNOS — CID 83157293

IUPAC4-chloro-2-methoxy-1,3-thiazole
SMILESCOc1nc(Cl)cs1
InChIInChI=1S/C4H4ClNOS/c1-7-4-6-3(5)2-8-4/h2H,1H3
InChIKeyZJVJELZRYKKHNW-UHFFFAOYSA-N
MW149.60 g/mol
LogP1.81
Rot. Bonds1

About 4-chloro-2-methoxy-1,3-thiazole

4-chloro-2-methoxy-1,3-thiazole (PubChem CID 83157293) has the molecular formula C4H4ClNOS and a molecular weight of 149.60 g/mol. Its IUPAC name is 4-chloro-2-methoxy-1,3-thiazole.

Molecular Properties

Compound Name4-chloro-2-methoxy-1,3-thiazole
PubChem CID83157293
Molecular FormulaC4H4ClNOS
Molecular Weight149.60 g/mol
Exact Mass148.97
IUPAC Name4-chloro-2-methoxy-1,3-thiazole
SMILESCOc1nc(Cl)cs1
InChIInChI=1S/C4H4ClNOS/c1-7-4-6-3(5)2-8-4/h2H,1H3
InChIKeyZJVJELZRYKKHNW-UHFFFAOYSA-N
XLogP1.81
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.60
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Dichlorothiazole
CID 12333155
4-Chloro-2-fluoro-1,3-thiazole
CID 45121780
4-Chloro-2-ethoxy-1,3-thiazole
CID 83157294
(2-Methoxy-1,3-thiazol-4-yl)-trimethylstannane
CID 18624221
4-Chloro-2-methylthiazole
CID 22087340
4-Fluoro-2-methoxy-1,3-thiazole
CID 68364879
4-Chloro-2-(trimethylsilyl)thiazole
CID 13613092
4-Chloro-2-(2,2,3,3-tetrafluoropropoxy)-1,3-thiazole
CID 83152026
4-Chloro-2-(2,2-difluoroethoxy)-1,3-thiazole
CID 83152988
4-Chloro-2-(4,4,4-trifluorobutoxy)-1,3-thiazole
CID 83153108
4-Chloro-2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazole
CID 83153347
4-Chloro-2-(3,3,3-trifluoropropoxy)-1,3-thiazole
CID 83153349

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methoxy-1,3-thiazole?
The IUPAC name of 4-chloro-2-methoxy-1,3-thiazole (CID 83157293) is 4-chloro-2-methoxy-1,3-thiazole.
What is the SMILES notation for 4-chloro-2-methoxy-1,3-thiazole?
The canonical SMILES for 4-chloro-2-methoxy-1,3-thiazole is COc1nc(Cl)cs1.
What is the InChIKey of 4-chloro-2-methoxy-1,3-thiazole?
The InChIKey is ZJVJELZRYKKHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4ClNOS/c1-7-4-6-3(5)2-8-4/h2H,1H3.
What are the key properties of 4-chloro-2-methoxy-1,3-thiazole?
4-chloro-2-methoxy-1,3-thiazole has a molecular weight of 149.60 g/mol, XLogP of 1.81, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methoxy-1,3-thiazole is sourced from PubChem (CID 83157293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).