3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine

C12H10N2S2 — CID 22892618

IUPAC3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine
SMILESCc1cscc1-c1nncc2c(C)csc12
InChIInChI=1S/C12H10N2S2/c1-7-4-15-6-10(7)11-12-9(3-13-14-11)8(2)5-16-12/h3-6H,1-2H3
InChIKeyUYMGWDDIQLASPL-UHFFFAOYSA-N
MW246.36 g/mol
LogP4.04
Rot. Bonds1

About 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine

3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine (PubChem CID 22892618) has the molecular formula C12H10N2S2 and a molecular weight of 246.36 g/mol. Its IUPAC name is 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine.

Molecular Properties

Compound Name3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine
PubChem CID22892618
Molecular FormulaC12H10N2S2
Molecular Weight246.36 g/mol
Exact Mass246.03
IUPAC Name3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine
SMILESCc1cscc1-c1nncc2c(C)csc12
InChIInChI=1S/C12H10N2S2/c1-7-4-15-6-10(7)11-12-9(3-13-14-11)8(2)5-16-12/h3-6H,1-2H3
InChIKeyUYMGWDDIQLASPL-UHFFFAOYSA-N
XLogP4.04
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Benzothieno[3,2-d]pyridazine
CID 11367440
5,7-Dimethylthieno[3,4-d]pyridazine
CID 22892613
7-[3-(Trifluoromethyl)phenyl]thieno[2,3-d]pyridazine
CID 12898449
2-Benzyl-7-(4-fluoro-2-methylphenyl)thieno[2,3-d]pyridazine
CID 59346427
7-(2-Fluoro-6-methylphenyl)thieno[2,3-d]pyridazine
CID 91547521
7-(4-Fluoro-3-methylphenyl)thieno[2,3-d]pyridazine
CID 175837676
7-(3-Tert-butyl-4-fluorophenyl)thieno[2,3-d]pyridazine
CID 175907123
Dithienodiazecine
CID 129803354
7-Thiophen-3-ylthieno[2,3-d]pyridazine
CID 10775202
7-Phenylthieno[2,3-d]pyridazine
CID 12898431
4-(Thiophen-2-yl)thieno[2,3-d]pyridazine
CID 13225497
4-(2,5-Dimethylthiophen-3-yl)-5,7-dimethylthieno[3,4-d]pyridazine
CID 22892578

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine?
The IUPAC name of 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine (CID 22892618) is 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine.
What is the SMILES notation for 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine?
The canonical SMILES for 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine is Cc1cscc1-c1nncc2c(C)csc12.
What is the InChIKey of 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine?
The InChIKey is UYMGWDDIQLASPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2S2/c1-7-4-15-6-10(7)11-12-9(3-13-14-11)8(2)5-16-12/h3-6H,1-2H3.
What are the key properties of 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine?
3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine has a molecular weight of 246.36 g/mol, XLogP of 4.04, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7-(4-methylthiophen-3-yl)thieno[2,3-d]pyridazine is sourced from PubChem (CID 22892618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).