5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide

C10H8Cl2N2O2S2 — CID 71066633

IUPAC5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccc(Cl)s1)C1=C(Cl)CCS1
InChIInChI=1S/C10H8Cl2N2O2S2/c11-5-3-4-17-8(5)10(16)14-13-9(15)6-1-2-7(12)18-6/h1-2H,3-4H2,(H,13,15)(H,14,16)
InChIKeyHSBVYGGGUNDRGG-UHFFFAOYSA-N
MW323.23 g/mol
LogP2.75
Rot. Bonds2

About 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide

5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide (PubChem CID 71066633) has the molecular formula C10H8Cl2N2O2S2 and a molecular weight of 323.23 g/mol. Its IUPAC name is 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide.

Molecular Properties

Compound Name5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide
PubChem CID71066633
Molecular FormulaC10H8Cl2N2O2S2
Molecular Weight323.23 g/mol
Exact Mass321.94
IUPAC Name5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccc(Cl)s1)C1=C(Cl)CCS1
InChIInChI=1S/C10H8Cl2N2O2S2/c11-5-3-4-17-8(5)10(16)14-13-9(15)6-1-2-7(12)18-6/h1-2H,3-4H2,(H,13,15)(H,14,16)
InChIKeyHSBVYGGGUNDRGG-UHFFFAOYSA-N
XLogP2.75
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.23
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide?
The IUPAC name of 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide (CID 71066633) is 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide.
What is the SMILES notation for 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide?
The canonical SMILES for 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide is O=C(NNC(=O)c1ccc(Cl)s1)C1=C(Cl)CCS1.
What is the InChIKey of 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide?
The InChIKey is HSBVYGGGUNDRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2O2S2/c11-5-3-4-17-8(5)10(16)14-13-9(15)6-1-2-7(12)18-6/h1-2H,3-4H2,(H,13,15)(H,14,16).
What are the key properties of 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide?
5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide has a molecular weight of 323.23 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N'-(4-chloro-2,3-dihydrothiophene-5-carbonyl)thiophene-2-carbohydrazide is sourced from PubChem (CID 71066633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).