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

C6H5N3S — CID 21139044

IUPAC6-methyl-[1,3]thiazolo[5,4-c]pyridazine
SMILESCc1nc2ccnnc2s1
InChIInChI=1S/C6H5N3S/c1-4-8-5-2-3-7-9-6(5)10-4/h2-3H,1H3
InChIKeyCNSQKCMADGHWKR-UHFFFAOYSA-N
MW151.19 g/mol
LogP1.39
Rot. Bonds

About 6-methyl-[1,3]thiazolo[5,4-c]pyridazine

6-methyl-[1,3]thiazolo[5,4-c]pyridazine (PubChem CID 21139044) has the molecular formula C6H5N3S and a molecular weight of 151.19 g/mol. Its IUPAC name is 6-methyl-[1,3]thiazolo[5,4-c]pyridazine.

Molecular Properties

Compound Name6-methyl-[1,3]thiazolo[5,4-c]pyridazine
PubChem CID21139044
Molecular FormulaC6H5N3S
Molecular Weight151.19 g/mol
Exact Mass151.02
IUPAC Name6-methyl-[1,3]thiazolo[5,4-c]pyridazine
SMILESCc1nc2ccnnc2s1
InChIInChI=1S/C6H5N3S/c1-4-8-5-2-3-7-9-6(5)10-4/h2-3H,1H3
InChIKeyCNSQKCMADGHWKR-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 6-methyl-[1,3]thiazolo[5,4-c]pyridazine?
The IUPAC name of 6-methyl-[1,3]thiazolo[5,4-c]pyridazine (CID 21139044) is 6-methyl-[1,3]thiazolo[5,4-c]pyridazine.
What is the SMILES notation for 6-methyl-[1,3]thiazolo[5,4-c]pyridazine?
The canonical SMILES for 6-methyl-[1,3]thiazolo[5,4-c]pyridazine is Cc1nc2ccnnc2s1.
What is the InChIKey of 6-methyl-[1,3]thiazolo[5,4-c]pyridazine?
The InChIKey is CNSQKCMADGHWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3S/c1-4-8-5-2-3-7-9-6(5)10-4/h2-3H,1H3.
What are the key properties of 6-methyl-[1,3]thiazolo[5,4-c]pyridazine?
6-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 6-methyl-[1,3]thiazolo[5,4-c]pyridazine is sourced from PubChem (CID 21139044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).