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

C14H12N4S2 — CID 83191648

IUPAC[2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(-c2csc3ccccc23)nc2c1CSC2
InChIInChI=1S/C14H12N4S2/c15-18-14-10-5-19-7-11(10)16-13(17-14)9-6-20-12-4-2-1-3-8(9)12/h1-4,6H,5,7,15H2,(H,16,17,18)
InChIKeyWHAWZTBIVPOOIY-UHFFFAOYSA-N
MW300.41 g/mol
LogP3.39
Rot. Bonds2

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

[2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine (PubChem CID 83191648) has the molecular formula C14H12N4S2 and a molecular weight of 300.41 g/mol. Its IUPAC name is [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
PubChem CID83191648
Molecular FormulaC14H12N4S2
Molecular Weight300.41 g/mol
Exact Mass300.05
IUPAC Name[2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
SMILESNNc1nc(-c2csc3ccccc23)nc2c1CSC2
InChIInChI=1S/C14H12N4S2/c15-18-14-10-5-19-7-11(10)16-13(17-14)9-6-20-12-4-2-1-3-8(9)12/h1-4,6H,5,7,15H2,(H,16,17,18)
InChIKeyWHAWZTBIVPOOIY-UHFFFAOYSA-N
XLogP3.39
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.41
LogP ≤ 53.39
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

(2,5-Dithiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)hydrazine
CID 24898259
6-Benzyl-2-(2-methyl-thiazol-4-yl)-thieno[2,3-d]pyrimidin-4-ylamine
CID 45274228
2-(4-Methyl-thiazol-2-yl)-6-(1-phenyl-vinyl)-thieno[2,3-d]pyrimidin-4-ylamine
CID 45275714
6-Benzyl-2-(4-methyl-thiazol-2-yl)-thieno[2,3-d]pyrimidin-4-ylamine
CID 45275717
(+/-)-2-(4-Methyl-thiazol-2-yl)-6-(1-phenyl-ethyl)-thieno[2,3-d]pyrimidin-4-ylamine
CID 45275818
3-(1-Benzothiophen-2-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 52948010
3-Methyl-6-(thiophen-2-yl)-[1,2,4]triazolo[3,4-a]phthalazine
CID 706123
(2-Phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)hydrazine
CID 947382
5,6-Dimethyl-7-(1-phenyl-ethyl)-2-thiophen-2-yl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine
CID 10783950
6-(thiophen-2-yl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-3-amine
CID 52948700
3,4,6-Trimethyl-1-phenyl-5-thiophen-2-ylpyrazolo[3,4-b]pyridine
CID 137661259
2-(1-benzothiophen-3-ylmethylsulfanyl)-5-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 164621556

Frequently Asked Questions

What is the IUPAC name of [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine (CID 83191648) is [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine is NNc1nc(-c2csc3ccccc23)nc2c1CSC2.
What is the InChIKey of [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
The InChIKey is WHAWZTBIVPOOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4S2/c15-18-14-10-5-19-7-11(10)16-13(17-14)9-6-20-12-4-2-1-3-8(9)12/h1-4,6H,5,7,15H2,(H,16,17,18).
What are the key properties of [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine?
[2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine has a molecular weight of 300.41 g/mol, XLogP of 3.39, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-benzothiophen-3-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 83191648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).