[2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine

C10H10N6S2 — CID 107782384

IUPAC[2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(CSc2ncc[nH]2)nc2sccc12
InChIInChI=1S/C10H10N6S2/c11-16-8-6-1-4-17-9(6)15-7(14-8)5-18-10-12-2-3-13-10/h1-4H,5,11H2,(H,12,13)(H,14,15,16)
InChIKeyALLGUBOFHIMHSS-UHFFFAOYSA-N
MW278.37 g/mol
LogP1.99
Rot. Bonds4

About [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine

[2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine (PubChem CID 107782384) has the molecular formula C10H10N6S2 and a molecular weight of 278.37 g/mol. Its IUPAC name is [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
PubChem CID107782384
Molecular FormulaC10H10N6S2
Molecular Weight278.37 g/mol
Exact Mass278.04
IUPAC Name[2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(CSc2ncc[nH]2)nc2sccc12
InChIInChI=1S/C10H10N6S2/c11-16-8-6-1-4-17-9(6)15-7(14-8)5-18-10-12-2-3-13-10/h1-4H,5,11H2,(H,12,13)(H,14,15,16)
InChIKeyALLGUBOFHIMHSS-UHFFFAOYSA-N
XLogP1.99
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 63482049
N-methyl-2-(pyrimidin-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 62189107
[2-(imidazol-1-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62244451
[2-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62250650
methyl 3-[(4-hydrazinylthieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoate
CID 55051000
[2-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62502703
[2-(3,3,3-trifluoropropyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 79965201
4-[(4-hydrazinylthieno[2,3-d]pyrimidin-2-yl)methoxy]benzonitrile
CID 62246202
2-[(4-hydrazinylthieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-propan-2-ylacetamide
CID 114234605
2-[(4-fluorophenyl)sulfanylmethyl]-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 62187683
2-(1H-imidazol-2-ylsulfanylmethyl)pyrimidin-4-amine
CID 130608073
N-propyl-2-(pyrimidin-4-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 63695901

Frequently Asked Questions

What is the IUPAC name of [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine (CID 107782384) is [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine is NNc1nc(CSc2ncc[nH]2)nc2sccc12.
What is the InChIKey of [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
The InChIKey is ALLGUBOFHIMHSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6S2/c11-16-8-6-1-4-17-9(6)15-7(14-8)5-18-10-12-2-3-13-10/h1-4H,5,11H2,(H,12,13)(H,14,15,16).
What are the key properties of [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine?
[2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine has a molecular weight of 278.37 g/mol, XLogP of 1.99, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1H-imidazol-2-ylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 107782384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).