2-chlorothieno[2,3-d]pyridazine

C6H3ClN2S — CID 67948177

IUPAC2-chlorothieno[2,3-d]pyridazine
SMILESClc1cc2cnncc2s1
InChIInChI=1S/C6H3ClN2S/c7-6-1-4-2-8-9-3-5(4)10-6/h1-3H
InChIKeyYSCSMBFXAGOLKR-UHFFFAOYSA-N
MW170.62 g/mol
LogP2.34
Rot. Bonds

About 2-chlorothieno[2,3-d]pyridazine

2-chlorothieno[2,3-d]pyridazine (PubChem CID 67948177) has the molecular formula C6H3ClN2S and a molecular weight of 170.62 g/mol. Its IUPAC name is 2-chlorothieno[2,3-d]pyridazine.

Molecular Properties

Compound Name2-chlorothieno[2,3-d]pyridazine
PubChem CID67948177
Molecular FormulaC6H3ClN2S
Molecular Weight170.62 g/mol
Exact Mass169.97
IUPAC Name2-chlorothieno[2,3-d]pyridazine
SMILESClc1cc2cnncc2s1
InChIInChI=1S/C6H3ClN2S/c7-6-1-4-2-8-9-3-5(4)10-6/h1-3H
InChIKeyYSCSMBFXAGOLKR-UHFFFAOYSA-N
XLogP2.34
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.62
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chlorothieno[2,3-d]pyridazine?
The IUPAC name of 2-chlorothieno[2,3-d]pyridazine (CID 67948177) is 2-chlorothieno[2,3-d]pyridazine.
What is the SMILES notation for 2-chlorothieno[2,3-d]pyridazine?
The canonical SMILES for 2-chlorothieno[2,3-d]pyridazine is Clc1cc2cnncc2s1.
What is the InChIKey of 2-chlorothieno[2,3-d]pyridazine?
The InChIKey is YSCSMBFXAGOLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3ClN2S/c7-6-1-4-2-8-9-3-5(4)10-6/h1-3H.
What are the key properties of 2-chlorothieno[2,3-d]pyridazine?
2-chlorothieno[2,3-d]pyridazine has a molecular weight of 170.62 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorothieno[2,3-d]pyridazine is sourced from PubChem (CID 67948177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).