4-methyl-[1,3]thiazolo[5,4-c]pyridazine

C6H5N3S — CID 58957225

IUPAC4-methyl-[1,3]thiazolo[5,4-c]pyridazine
SMILESCc1cnnc2scnc12
InChIInChI=1S/C6H5N3S/c1-4-2-8-9-6-5(4)7-3-10-6/h2-3H,1H3
InChIKeyNRYXQOVLRWPIAK-UHFFFAOYSA-N
MW151.19 g/mol
LogP1.39
Rot. Bonds

About 4-methyl-[1,3]thiazolo[5,4-c]pyridazine

4-methyl-[1,3]thiazolo[5,4-c]pyridazine (PubChem CID 58957225) has the molecular formula C6H5N3S and a molecular weight of 151.19 g/mol. Its IUPAC name is 4-methyl-[1,3]thiazolo[5,4-c]pyridazine.

Molecular Properties

Compound Name4-methyl-[1,3]thiazolo[5,4-c]pyridazine
PubChem CID58957225
Molecular FormulaC6H5N3S
Molecular Weight151.19 g/mol
Exact Mass151.02
IUPAC Name4-methyl-[1,3]thiazolo[5,4-c]pyridazine
SMILESCc1cnnc2scnc12
InChIInChI=1S/C6H5N3S/c1-4-2-8-9-6-5(4)7-3-10-6/h2-3H,1H3
InChIKeyNRYXQOVLRWPIAK-UHFFFAOYSA-N
XLogP1.39
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.19
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-[1,3]thiazolo[5,4-c]pyridazine?
The IUPAC name of 4-methyl-[1,3]thiazolo[5,4-c]pyridazine (CID 58957225) is 4-methyl-[1,3]thiazolo[5,4-c]pyridazine.
What is the SMILES notation for 4-methyl-[1,3]thiazolo[5,4-c]pyridazine?
The canonical SMILES for 4-methyl-[1,3]thiazolo[5,4-c]pyridazine is Cc1cnnc2scnc12.
What is the InChIKey of 4-methyl-[1,3]thiazolo[5,4-c]pyridazine?
The InChIKey is NRYXQOVLRWPIAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3S/c1-4-2-8-9-6-5(4)7-3-10-6/h2-3H,1H3.
What are the key properties of 4-methyl-[1,3]thiazolo[5,4-c]pyridazine?
4-methyl-[1,3]thiazolo[5,4-c]pyridazine has a molecular weight of 151.19 g/mol, XLogP of 1.39, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-[1,3]thiazolo[5,4-c]pyridazine is sourced from PubChem (CID 58957225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).