[1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine

C17H14N2S2 — CID 105327686

IUPAC[1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine
SMILESNNC(c1cc2ccccc2s1)c1cccc2ccsc12
InChIInChI=1S/C17H14N2S2/c18-19-16(13-6-3-5-11-8-9-20-17(11)13)15-10-12-4-1-2-7-14(12)21-15/h1-10,16,19H,18H2
InChIKeyRBVCQKMYXHIAAQ-UHFFFAOYSA-N
MW310.45 g/mol
LogP4.67
Rot. Bonds3

About [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine

[1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine (PubChem CID 105327686) has the molecular formula C17H14N2S2 and a molecular weight of 310.45 g/mol. Its IUPAC name is [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine.

Molecular Properties

Compound Name[1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine
PubChem CID105327686
Molecular FormulaC17H14N2S2
Molecular Weight310.45 g/mol
Exact Mass310.06
IUPAC Name[1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine
SMILESNNC(c1cc2ccccc2s1)c1cccc2ccsc12
InChIInChI=1S/C17H14N2S2/c18-19-16(13-6-3-5-11-8-9-20-17(11)13)15-10-12-4-1-2-7-14(12)21-15/h1-10,16,19H,18H2
InChIKeyRBVCQKMYXHIAAQ-UHFFFAOYSA-N
XLogP4.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.45
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine?
The IUPAC name of [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine (CID 105327686) is [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine.
What is the SMILES notation for [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine?
The canonical SMILES for [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine is NNC(c1cc2ccccc2s1)c1cccc2ccsc12.
What is the InChIKey of [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine?
The InChIKey is RBVCQKMYXHIAAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2S2/c18-19-16(13-6-3-5-11-8-9-20-17(11)13)15-10-12-4-1-2-7-14(12)21-15/h1-10,16,19H,18H2.
What are the key properties of [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine?
[1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine has a molecular weight of 310.45 g/mol, XLogP of 4.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzothiophen-2-yl(1-benzothiophen-7-yl)methyl]hydrazine is sourced from PubChem (CID 105327686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).