actinium;2-piperazin-4-id-1-yl-1,3-thiazole

C7H10AcN3S- — CID 59036745

IUPACactinium;2-piperazin-4-id-1-yl-1,3-thiazole
SMILES[Ac].c1csc(N2CC[N-]CC2)n1
InChIInChI=1S/C7H10N3S.Ac/c1-4-10(5-2-8-1)7-9-3-6-11-7;/h3,6H,1-2,4-5H2;/q-1;
InChIKeyGTGHUHGGRIYRCE-UHFFFAOYSA-N
MW395.25 g/mol
LogP1.34
Rot. Bonds1

About actinium;2-piperazin-4-id-1-yl-1,3-thiazole

actinium;2-piperazin-4-id-1-yl-1,3-thiazole (PubChem CID 59036745) has the molecular formula C7H10AcN3S- and a molecular weight of 395.25 g/mol. Its IUPAC name is actinium;2-piperazin-4-id-1-yl-1,3-thiazole.

Molecular Properties

Compound Nameactinium;2-piperazin-4-id-1-yl-1,3-thiazole
PubChem CID59036745
Molecular FormulaC7H10AcN3S-
Molecular Weight395.25 g/mol
Exact Mass395.09
IUPAC Nameactinium;2-piperazin-4-id-1-yl-1,3-thiazole
SMILES[Ac].c1csc(N2CC[N-]CC2)n1
InChIInChI=1S/C7H10N3S.Ac/c1-4-10(5-2-8-1)7-9-3-6-11-7;/h3,6H,1-2,4-5H2;/q-1;
InChIKeyGTGHUHGGRIYRCE-UHFFFAOYSA-N
XLogP1.34
TPSA30.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.25
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of actinium;2-piperazin-4-id-1-yl-1,3-thiazole?
The IUPAC name of actinium;2-piperazin-4-id-1-yl-1,3-thiazole (CID 59036745) is actinium;2-piperazin-4-id-1-yl-1,3-thiazole.
What is the SMILES notation for actinium;2-piperazin-4-id-1-yl-1,3-thiazole?
The canonical SMILES for actinium;2-piperazin-4-id-1-yl-1,3-thiazole is [Ac].c1csc(N2CC[N-]CC2)n1.
What is the InChIKey of actinium;2-piperazin-4-id-1-yl-1,3-thiazole?
The InChIKey is GTGHUHGGRIYRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N3S.Ac/c1-4-10(5-2-8-1)7-9-3-6-11-7;/h3,6H,1-2,4-5H2;/q-1;.
What are the key properties of actinium;2-piperazin-4-id-1-yl-1,3-thiazole?
actinium;2-piperazin-4-id-1-yl-1,3-thiazole has a molecular weight of 395.25 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for actinium;2-piperazin-4-id-1-yl-1,3-thiazole is sourced from PubChem (CID 59036745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).