4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine

C7H5ClN2S — CID 76850479

IUPAC4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine
SMILESCc1cnc(Cl)c2ncsc12
InChIInChI=1S/C7H5ClN2S/c1-4-2-9-7(8)5-6(4)11-3-10-5/h2-3H,1H3
InChIKeyIUOZHXGQEJBOKP-UHFFFAOYSA-N
MW184.65 g/mol
LogP2.65
Rot. Bonds

About 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine

4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine (PubChem CID 76850479) has the molecular formula C7H5ClN2S and a molecular weight of 184.65 g/mol. Its IUPAC name is 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Name4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine
PubChem CID76850479
Molecular FormulaC7H5ClN2S
Molecular Weight184.65 g/mol
Exact Mass183.99
IUPAC Name4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine
SMILESCc1cnc(Cl)c2ncsc12
InChIInChI=1S/C7H5ClN2S/c1-4-2-9-7(8)5-6(4)11-3-10-5/h2-3H,1H3
InChIKeyIUOZHXGQEJBOKP-UHFFFAOYSA-N
XLogP2.65
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.65
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6,7-dimethyl-[1,3]thiazolo[5,4-b]pyridine;ethane
CID 144514698
4-chloro-2,7-dimethylthieno[3,2-c]pyridine
CID 130047480
4,7-dichloro-1,3-benzothiazole
CID 23199467
7-chloro-6-methyl-1,3-benzothiazole
CID 67962941
5-chloro-7-methyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 83828889
4,6,7-trimethyl-[1,3]thiazolo[4,5-c]pyridine
CID 166990343
4-chloro-[1,3]thiazolo[4,5-c]quinoline
CID 141201536
5-chloro-6-methyl-[1,3]thiazolo[5,4-b]pyridine
CID 154727392
7-chloro-2,4-dimethylthieno[2,3-c]pyridine
CID 130048871
4-(2,2-dimethylpropyl)-7-methyl-1,3-benzothiazole
CID 91353241
7-ethyl-4-methyl-[1,3]thiazolo[5,4-c]pyridine
CID 91016106
7-chloro-5-methylsulfanyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 89272586

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine?
The IUPAC name of 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine (CID 76850479) is 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine.
What is the SMILES notation for 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine?
The canonical SMILES for 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine is Cc1cnc(Cl)c2ncsc12.
What is the InChIKey of 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine?
The InChIKey is IUOZHXGQEJBOKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2S/c1-4-2-9-7(8)5-6(4)11-3-10-5/h2-3H,1H3.
What are the key properties of 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine?
4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine has a molecular weight of 184.65 g/mol, XLogP of 2.65, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7-methyl-[1,3]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 76850479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).