4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine

C11H11Cl2N3OS — CID 134835005

IUPAC4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine
SMILESClC(Cl)c1ccnc2nc(N3CCOCC3)sc12
InChIInChI=1S/C11H11Cl2N3OS/c12-9(13)7-1-2-14-10-8(7)18-11(15-10)16-3-5-17-6-4-16/h1-2,9H,3-6H2
InChIKeyGSONMIKTSYBAJV-UHFFFAOYSA-N
MW304.20 g/mol
LogP3.00
Rot. Bonds2

About 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine

4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine (PubChem CID 134835005) has the molecular formula C11H11Cl2N3OS and a molecular weight of 304.20 g/mol. Its IUPAC name is 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine.

Molecular Properties

Compound Name4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine
PubChem CID134835005
Molecular FormulaC11H11Cl2N3OS
Molecular Weight304.20 g/mol
Exact Mass303.00
IUPAC Name4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine
SMILESClC(Cl)c1ccnc2nc(N3CCOCC3)sc12
InChIInChI=1S/C11H11Cl2N3OS/c12-9(13)7-1-2-14-10-8(7)18-11(15-10)16-3-5-17-6-4-16/h1-2,9H,3-6H2
InChIKeyGSONMIKTSYBAJV-UHFFFAOYSA-N
XLogP3.00
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.20
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine with MolForge

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

Launch Full Analysis

Related Compounds

4-[5-(Dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine
CID 134858221
Thiazolo[4,5-b]pyridine-7-carbaldehyde,2-(1-piperidinyl)-
CID 76850430
7-(Dichloromethyl)-2-piperidin-1-yl-[1,3]thiazolo[4,5-b]pyridine
CID 134835182
2-Chloro-7-methyl-[1,3]thiazolo[4,5-b]pyridine
CID 57448379
2,7-Dimethyl-[1,3]thiazolo[4,5-b]pyridine
CID 58077927
4-(5-Pyridin-3-yl-[1,3]thiazolo[4,5-d]pyrimidin-7-yl)morpholine
CID 58507806
2-Ethyl-7-methyl-[1,3]thiazolo[4,5-b]pyridine
CID 59298218
2-methoxy-N-methyl-N-[2-[4-[(7-methyl-[1,3]thiazolo[4,5-b]pyridin-2-yl)oxy]cyclohexa-1,5-dien-1-yl]oxyethyl]ethanamine
CID 68333860
(2S,6R)-4-(5-chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)-2,6-dimethylmorpholine
CID 118224184
4-(5-Chlorothiazolo[4,5-B]pyridin-2-YL)morpholine
CID 118224392
4-([1,3]Thiazolo[4,5-b]pyridin-2-yl)morpholine
CID 118224437
4-(6-Chloro-[1,3]thiazolo[4,5-b]pyridin-2-yl)morpholine
CID 139309577

Frequently Asked Questions

What is the IUPAC name of 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine?
The IUPAC name of 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine (CID 134835005) is 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine.
What is the SMILES notation for 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine?
The canonical SMILES for 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine is ClC(Cl)c1ccnc2nc(N3CCOCC3)sc12.
What is the InChIKey of 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine?
The InChIKey is GSONMIKTSYBAJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl2N3OS/c12-9(13)7-1-2-14-10-8(7)18-11(15-10)16-3-5-17-6-4-16/h1-2,9H,3-6H2.
What are the key properties of 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine?
4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine has a molecular weight of 304.20 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-(dichloromethyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]morpholine is sourced from PubChem (CID 134835005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).