5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine

C7H5ClN2S — CID 76850305

IUPAC5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCc1nc2nc(Cl)ccc2s1
InChIInChI=1S/C7H5ClN2S/c1-4-9-7-5(11-4)2-3-6(8)10-7/h2-3H,1H3
InChIKeyKJBDQSQBKHFXAR-UHFFFAOYSA-N
MW184.65 g/mol
LogP2.65
Rot. Bonds

About 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine

5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 76850305) has the molecular formula C7H5ClN2S and a molecular weight of 184.65 g/mol. Its IUPAC name is 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine
PubChem CID76850305
Molecular FormulaC7H5ClN2S
Molecular Weight184.65 g/mol
Exact Mass183.99
IUPAC Name5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCc1nc2nc(Cl)ccc2s1
InChIInChI=1S/C7H5ClN2S/c1-4-9-7-5(11-4)2-3-6(8)10-7/h2-3H,1H3
InChIKeyKJBDQSQBKHFXAR-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

[1,3]Thiazolo[4,5-b]pyridine
CID 20059202
2-Chloro-(1,3)thiazolo(4,5-b)pyridine
CID 51358428
4-Chloro-2-ethylthieno(3,2-d)pyrimidine
CID 10703140
6-Chloro-2-(methylsulfanyl)-(1,3)thiazolo(4,5-b)pyridine
CID 12116492
4-Chloro-2-methylthieno[3,2-d]pyrimidine
CID 22674459
2,6-Dichloro-(1,3)thiazolo(4,5-b)pyridine
CID 57448375
7-Chloro-2-methyl-(1,3)thiazolo(4,5-b)pyridine
CID 83828816
[1,3]Thiazolo[4,5-b]pyridine-2,5-diamine
CID 2337481
5-Chloro-(1,3)thiazolo(4,5-b)pyridine
CID 83827223
2,7-Dichloro-5-(trifluoromethyl)-[1,3]thiazolo[4,5-b]pyridine
CID 69032213
5-Chloro-2-(2-fluoro-6-pyrrolidin-1-yl-3-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine
CID 130416470
6-Fluoro-2,5-dimethyl-[1,3]thiazolo[4,5-b]pyridine
CID 146284815

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine (CID 76850305) is 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine is Cc1nc2nc(Cl)ccc2s1.
What is the InChIKey of 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is KJBDQSQBKHFXAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2S/c1-4-9-7-5(11-4)2-3-6(8)10-7/h2-3H,1H3.
What are the key properties of 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine?
5-chloro-2-methyl-[1,3]thiazolo[4,5-b]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 5-chloro-2-methyl-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 76850305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).