3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine

C17H17N3S2 — CID 142383410

IUPAC3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine
SMILESCC1(C)N=C(c2cc3ccsc3nn2)c2sccc2C1(C)C
InChIInChI=1S/C17H17N3S2/c1-16(2)11-6-8-21-14(11)13(18-17(16,3)4)12-9-10-5-7-22-15(10)20-19-12/h5-9H,1-4H3
InChIKeyHSBDUJZXBOFABZ-UHFFFAOYSA-N
MW327.48 g/mol
LogP4.66
Rot. Bonds1

About 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine

3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine (PubChem CID 142383410) has the molecular formula C17H17N3S2 and a molecular weight of 327.48 g/mol. Its IUPAC name is 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine.

Molecular Properties

Compound Name3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine
PubChem CID142383410
Molecular FormulaC17H17N3S2
Molecular Weight327.48 g/mol
Exact Mass327.09
IUPAC Name3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine
SMILESCC1(C)N=C(c2cc3ccsc3nn2)c2sccc2C1(C)C
InChIInChI=1S/C17H17N3S2/c1-16(2)11-6-8-21-14(11)13(18-17(16,3)4)12-9-10-5-7-22-15(10)20-19-12/h5-9H,1-4H3
InChIKeyHSBDUJZXBOFABZ-UHFFFAOYSA-N
XLogP4.66
TPSA38.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.48
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine with MolForge

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Related Compounds

3-((2-Methylbenzyl)thio)-6-(thiophen-2-yl)pyridazine
CID 16019285
3-Benzylsulfanyl-6-thiophen-2-ylpyridazine
CID 6624149
3-[(4-Methylbenzyl)thio]-6-(2-thienyl)pyridazine
CID 12006141
3-[(3-Methylphenyl)methylthio]-6-thiophen-2-ylpyridazine
CID 12006192
7-Cinnolin-3-yl-4-fluoro-4,5,5-trimethylthieno[2,3-c]pyridine
CID 135152658
3-(4,4-Difluoro-5,5-dimethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine
CID 135152668
3-(5-fluoro-3,3-dimethyl-4H-isoquinolin-1-yl)thieno[2,3-c]pyridazine
CID 135153102
3-(5-fluoro-3,3-dimethyl-4H-isoquinolin-1-yl)thieno[3,2-c]pyridazine
CID 135153190
5-ethyl-7-(8-fluorocinnolin-3-yl)-5-methyl-4H-thieno[2,3-c]pyridine
CID 135153594
3-(4-Methylthiophen-2-yl)-6-phenylsulfanyl-4-(4-phenylthiophen-2-yl)pyridazine
CID 18760026
1,4-Bis[4-hexyl-5-[5-[5-(3-hexyl-5-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thieno[3,4-d]pyridazine
CID 58273783
3-Methylthieno[2,3-c]pyridazine
CID 58957247

Frequently Asked Questions

What is the IUPAC name of 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine?
The IUPAC name of 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine (CID 142383410) is 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine.
What is the SMILES notation for 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine?
The canonical SMILES for 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine is CC1(C)N=C(c2cc3ccsc3nn2)c2sccc2C1(C)C.
What is the InChIKey of 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine?
The InChIKey is HSBDUJZXBOFABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3S2/c1-16(2)11-6-8-21-14(11)13(18-17(16,3)4)12-9-10-5-7-22-15(10)20-19-12/h5-9H,1-4H3.
What are the key properties of 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine?
3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine has a molecular weight of 327.48 g/mol, XLogP of 4.66, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4,5,5-tetramethylthieno[2,3-c]pyridin-7-yl)thieno[2,3-c]pyridazine is sourced from PubChem (CID 142383410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).