[2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine

C14H12N4OS — CID 83191632

IUPAC[2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(-c2coc3ccccc23)nc2c1CSC2
InChIInChI=1S/C14H12N4OS/c15-18-14-10-6-20-7-11(10)16-13(17-14)9-5-19-12-4-2-1-3-8(9)12/h1-5H,6-7,15H2,(H,16,17,18)
InChIKeyNWPWLHCJIHCPNO-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.92
Rot. Bonds2

About [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine

[2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine (PubChem CID 83191632) has the molecular formula C14H12N4OS and a molecular weight of 284.34 g/mol. Its IUPAC name is [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
PubChem CID83191632
Molecular FormulaC14H12N4OS
Molecular Weight284.34 g/mol
Exact Mass284.07
IUPAC Name[2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(-c2coc3ccccc23)nc2c1CSC2
InChIInChI=1S/C14H12N4OS/c15-18-14-10-6-20-7-11(10)16-13(17-14)9-5-19-12-4-2-1-3-8(9)12/h1-5H,6-7,15H2,(H,16,17,18)
InChIKeyNWPWLHCJIHCPNO-UHFFFAOYSA-N
XLogP2.92
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83191648
[2-(furan-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83200762
[2-(2,4-dichlorophenyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83200934
[2-(5-bromothiophen-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83200526
[2-[5-(2-methylcyclopropyl)furan-2-yl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83191670
[2-(1,3-benzodioxol-5-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83191661
[2-(thiophen-2-ylmethyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83201587
[2-(4,5-dibromothiophen-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 102844254
2-(1-benzothiophen-3-yl)-N-ethyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83193425
3-(1-benzofuran-3-yl)-5-iodo-1,2,4-thiadiazole
CID 102618702
2-(2-ethylphenyl)-N-methyl-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 83200586
[2-[(2-methoxyphenyl)methyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83201588

Frequently Asked Questions

What is the IUPAC name of [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine (CID 83191632) is [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine is NNc1nc(-c2coc3ccccc23)nc2c1CSC2.
What is the InChIKey of [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The InChIKey is NWPWLHCJIHCPNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4OS/c15-18-14-10-6-20-7-11(10)16-13(17-14)9-5-19-12-4-2-1-3-8(9)12/h1-5H,6-7,15H2,(H,16,17,18).
What are the key properties of [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
[2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine has a molecular weight of 284.34 g/mol, XLogP of 2.92, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-benzofuran-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 83191632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).