thieno[3,2-d]triazine

C5H3N3S — CID 66624199

IUPACthieno[3,2-d]triazine
SMILESc1cc2nnncc2s1
InChIInChI=1S/C5H3N3S/c1-2-9-5-3-6-8-7-4(1)5/h1-3H
InChIKeyDDXXAXFVICOMLN-UHFFFAOYSA-N
MW137.17 g/mol
LogP1.09
Rot. Bonds

About thieno[3,2-d]triazine

thieno[3,2-d]triazine (PubChem CID 66624199) has the molecular formula C5H3N3S and a molecular weight of 137.17 g/mol. Its IUPAC name is thieno[3,2-d]triazine.

Molecular Properties

Compound Namethieno[3,2-d]triazine
PubChem CID66624199
Molecular FormulaC5H3N3S
Molecular Weight137.17 g/mol
Exact Mass137.00
IUPAC Namethieno[3,2-d]triazine
SMILESc1cc2nnncc2s1
InChIInChI=1S/C5H3N3S/c1-2-9-5-3-6-8-7-4(1)5/h1-3H
InChIKeyDDXXAXFVICOMLN-UHFFFAOYSA-N
XLogP1.09
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.17
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of thieno[3,2-d]triazine?
The IUPAC name of thieno[3,2-d]triazine (CID 66624199) is thieno[3,2-d]triazine.
What is the SMILES notation for thieno[3,2-d]triazine?
The canonical SMILES for thieno[3,2-d]triazine is c1cc2nnncc2s1.
What is the InChIKey of thieno[3,2-d]triazine?
The InChIKey is DDXXAXFVICOMLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3N3S/c1-2-9-5-3-6-8-7-4(1)5/h1-3H.
What are the key properties of thieno[3,2-d]triazine?
thieno[3,2-d]triazine has a molecular weight of 137.17 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[3,2-d]triazine is sourced from PubChem (CID 66624199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).