5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine

C7H6N4OS2 — CID 15729207

IUPAC5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine
SMILESNc1ncc(S(=O)c2ncccn2)s1
InChIInChI=1S/C7H6N4OS2/c8-6-11-4-5(13-6)14(12)7-9-2-1-3-10-7/h1-4H,(H2,8,11)
InChIKeyYTYDLVCHNWUPHO-UHFFFAOYSA-N
MW226.29 g/mol
LogP0.68
Rot. Bonds2

About 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine

5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine (PubChem CID 15729207) has the molecular formula C7H6N4OS2 and a molecular weight of 226.29 g/mol. Its IUPAC name is 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine
PubChem CID15729207
Molecular FormulaC7H6N4OS2
Molecular Weight226.29 g/mol
Exact Mass226.00
IUPAC Name5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine
SMILESNc1ncc(S(=O)c2ncccn2)s1
InChIInChI=1S/C7H6N4OS2/c8-6-11-4-5(13-6)14(12)7-9-2-1-3-10-7/h1-4H,(H2,8,11)
InChIKeyYTYDLVCHNWUPHO-UHFFFAOYSA-N
XLogP0.68
TPSA81.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.29
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine?
The IUPAC name of 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine (CID 15729207) is 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine is Nc1ncc(S(=O)c2ncccn2)s1.
What is the InChIKey of 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine?
The InChIKey is YTYDLVCHNWUPHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N4OS2/c8-6-11-4-5(13-6)14(12)7-9-2-1-3-10-7/h1-4H,(H2,8,11).
What are the key properties of 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine?
5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine has a molecular weight of 226.29 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrimidin-2-ylsulfinyl-1,3-thiazol-2-amine is sourced from PubChem (CID 15729207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).