7-ethyl-4-methylthieno[2,3-d]pyridazine

C9H10N2S — CID 89250457

IUPAC7-ethyl-4-methylthieno[2,3-d]pyridazine
SMILESCCc1nnc(C)c2ccsc12
InChIInChI=1S/C9H10N2S/c1-3-8-9-7(4-5-12-9)6(2)10-11-8/h4-5H,3H2,1-2H3
InChIKeyNNSMJAKKTJKVLX-UHFFFAOYSA-N
MW178.26 g/mol
LogP2.56
Rot. Bonds1

About 7-ethyl-4-methylthieno[2,3-d]pyridazine

7-ethyl-4-methylthieno[2,3-d]pyridazine (PubChem CID 89250457) has the molecular formula C9H10N2S and a molecular weight of 178.26 g/mol. Its IUPAC name is 7-ethyl-4-methylthieno[2,3-d]pyridazine.

Molecular Properties

Compound Name7-ethyl-4-methylthieno[2,3-d]pyridazine
PubChem CID89250457
Molecular FormulaC9H10N2S
Molecular Weight178.26 g/mol
Exact Mass178.06
IUPAC Name7-ethyl-4-methylthieno[2,3-d]pyridazine
SMILESCCc1nnc(C)c2ccsc12
InChIInChI=1S/C9H10N2S/c1-3-8-9-7(4-5-12-9)6(2)10-11-8/h4-5H,3H2,1-2H3
InChIKeyNNSMJAKKTJKVLX-UHFFFAOYSA-N
XLogP2.56
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Benzylthio)-6-(thiophen-2-yl)pyridazine
CID 6624149
3-[(4-Methylbenzyl)thio]-6-(2-thienyl)pyridazine
CID 12006141
3-Phenyl-6-(thiophen-2-yl)pyridazine
CID 12440089
7-(2-Fluoro-6-methylphenyl)thieno[2,3-d]pyridazine
CID 91547521
4-(2,6-Dimethylphenyl)sulfanyl-7-[3-(trifluoromethyl)phenyl]thieno[2,3-d]pyridazine
CID 154634196
4,7-Bis[3-(trifluoromethyl)phenyl]thieno[2,3-d]pyridazine
CID 154634760
4,7-Bis[3,5-bis(trifluoromethyl)phenyl]thieno[2,3-d]pyridazine
CID 154634761
4-Chloro-7-(4-fluoro-3-methylphenyl)thieno[2,3-d]pyridazine
CID 154634762
7-(4-Fluoro-3-methylphenyl)thieno[2,3-d]pyridazine
CID 175837676
7-(4-Fluoro-3-methylphenyl)-4-(2,4,6-trimethylphenyl)thieno[2,3-d]pyridazine
CID 175837679
4-[3,5-Bis(trifluoromethyl)phenyl]-7-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyridazine
CID 176310920
4,7-Ditert-butyl-3-fluorothieno[2,3-d]pyridazine
CID 176700940

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-4-methylthieno[2,3-d]pyridazine?
The IUPAC name of 7-ethyl-4-methylthieno[2,3-d]pyridazine (CID 89250457) is 7-ethyl-4-methylthieno[2,3-d]pyridazine.
What is the SMILES notation for 7-ethyl-4-methylthieno[2,3-d]pyridazine?
The canonical SMILES for 7-ethyl-4-methylthieno[2,3-d]pyridazine is CCc1nnc(C)c2ccsc12.
What is the InChIKey of 7-ethyl-4-methylthieno[2,3-d]pyridazine?
The InChIKey is NNSMJAKKTJKVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S/c1-3-8-9-7(4-5-12-9)6(2)10-11-8/h4-5H,3H2,1-2H3.
What are the key properties of 7-ethyl-4-methylthieno[2,3-d]pyridazine?
7-ethyl-4-methylthieno[2,3-d]pyridazine has a molecular weight of 178.26 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-4-methylthieno[2,3-d]pyridazine is sourced from PubChem (CID 89250457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).