5-chloro-3-(5-chlorothiophen-2-yl)pyridazine

C8H4Cl2N2S — CID 117106403

IUPAC5-chloro-3-(5-chlorothiophen-2-yl)pyridazine
SMILESClc1cnnc(-c2ccc(Cl)s2)c1
InChIInChI=1S/C8H4Cl2N2S/c9-5-3-6(12-11-4-5)7-1-2-8(10)13-7/h1-4H
InChIKeyNLHPEPSTVFTSMF-UHFFFAOYSA-N
MW231.11 g/mol
LogP3.51
Rot. Bonds1

About 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine

5-chloro-3-(5-chlorothiophen-2-yl)pyridazine (PubChem CID 117106403) has the molecular formula C8H4Cl2N2S and a molecular weight of 231.11 g/mol. Its IUPAC name is 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine.

Molecular Properties

Compound Name5-chloro-3-(5-chlorothiophen-2-yl)pyridazine
PubChem CID117106403
Molecular FormulaC8H4Cl2N2S
Molecular Weight231.11 g/mol
Exact Mass229.95
IUPAC Name5-chloro-3-(5-chlorothiophen-2-yl)pyridazine
SMILESClc1cnnc(-c2ccc(Cl)s2)c1
InChIInChI=1S/C8H4Cl2N2S/c9-5-3-6(12-11-4-5)7-1-2-8(10)13-7/h1-4H
InChIKeyNLHPEPSTVFTSMF-UHFFFAOYSA-N
XLogP3.51
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.11
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 5-(5-chloropyridazin-3-yl)thiophene-2-carboxylate
CID 118468626
4-(5-chlorothiophen-2-yl)thiadiazole
CID 587020
5-chloro-3-(2-fluorophenyl)pyridazine
CID 117107044
5-chloro-3-(3-methylphenyl)pyridazine
CID 117106953
5-chloro-2-(5-chlorothiophen-2-yl)-1,3-oxazole
CID 117258864
3-(5-chlorothiophen-2-yl)-1-methylpyrazole-5-carboxylic acid
CID 82293487
5-(bromomethyl)-3-(5-chlorothiophen-2-yl)-1,2-oxazole
CID 22394374
2-[6-(5-chlorothiophen-2-yl)-3-pyridinyl]-2-oxoacetamide
CID 144811588
4-(5-chlorothiophen-2-yl)-1H-pyrazole
CID 901421
2-(5-chlorothiophen-2-yl)-5-methyl-1,3-thiazole
CID 59009299
4-chloro-6-(5-chlorothiophen-2-yl)-2-ethylpyrimidine
CID 80936573
2-(5-chlorothiophen-2-yl)-1H-pyridin-4-one
CID 106519910

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine?
The IUPAC name of 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine (CID 117106403) is 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine.
What is the SMILES notation for 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine?
The canonical SMILES for 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine is Clc1cnnc(-c2ccc(Cl)s2)c1.
What is the InChIKey of 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine?
The InChIKey is NLHPEPSTVFTSMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4Cl2N2S/c9-5-3-6(12-11-4-5)7-1-2-8(10)13-7/h1-4H.
What are the key properties of 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine?
5-chloro-3-(5-chlorothiophen-2-yl)pyridazine has a molecular weight of 231.11 g/mol, XLogP of 3.51, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(5-chlorothiophen-2-yl)pyridazine is sourced from PubChem (CID 117106403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).