[2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine

C15H16Cl2N2S2 — CID 105295023

IUPAC[2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)cc1Cl)c1cc2c(s1)CCSC2
InChIInChI=1S/C15H16Cl2N2S2/c16-11-2-1-9(12(17)7-11)5-13(19-18)15-6-10-8-20-4-3-14(10)21-15/h1-2,6-7,13,19H,3-5,8,18H2
InChIKeyRHQFGUQCZYIVFM-UHFFFAOYSA-N
MW359.35 g/mol
LogP4.59
Rot. Bonds4

About [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine

[2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine (PubChem CID 105295023) has the molecular formula C15H16Cl2N2S2 and a molecular weight of 359.35 g/mol. Its IUPAC name is [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine
PubChem CID105295023
Molecular FormulaC15H16Cl2N2S2
Molecular Weight359.35 g/mol
Exact Mass358.01
IUPAC Name[2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine
SMILESNNC(Cc1ccc(Cl)cc1Cl)c1cc2c(s1)CCSC2
InChIInChI=1S/C15H16Cl2N2S2/c16-11-2-1-9(12(17)7-11)5-13(19-18)15-6-10-8-20-4-3-14(10)21-15/h1-2,6-7,13,19H,3-5,8,18H2
InChIKeyRHQFGUQCZYIVFM-UHFFFAOYSA-N
XLogP4.59
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.35
LogP ≤ 54.59
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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Related Compounds

2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)-N-methylethanamine
CID 115839950
[1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)-2-thiophen-3-ylethyl]hydrazine
CID 105297674
[2-(4-chloro-2-fluorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
CID 105342696
2-(2-chloro-4-fluorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethanol
CID 115785402
2-(2-chlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)-N-ethylethanamine
CID 81266579
2-(4-bromo-2-chlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethanamine
CID 105037851
[2-(5-chloro-2-fluorophenyl)-1-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)ethyl]hydrazine
CID 103053843
[2-cyclopentyl-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine
CID 105298978
[1-(5-bromothiophen-2-yl)-2-(2,4-dichlorophenyl)ethyl]hydrazine
CID 105222238
2-[1-chloro-2-(2-chlorophenyl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]thiopyran
CID 81261787
[2-(4-chlorophenyl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethyl]hydrazine
CID 105283232
1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)nonylhydrazine
CID 105294340

Frequently Asked Questions

What is the IUPAC name of [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine (CID 105295023) is [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine is NNC(Cc1ccc(Cl)cc1Cl)c1cc2c(s1)CCSC2.
What is the InChIKey of [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine?
The InChIKey is RHQFGUQCZYIVFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2S2/c16-11-2-1-9(12(17)7-11)5-13(19-18)15-6-10-8-20-4-3-14(10)21-15/h1-2,6-7,13,19H,3-5,8,18H2.
What are the key properties of [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine?
[2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine has a molecular weight of 359.35 g/mol, XLogP of 4.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,4-dichlorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105295023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).