3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide

C10H6Cl2N2O2S2 — CID 25225987

IUPAC3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)c1sccc1Cl)c1ccc(Cl)s1
InChIInChI=1S/C10H6Cl2N2O2S2/c11-5-3-4-17-8(5)10(16)14-13-9(15)6-1-2-7(12)18-6/h1-4H,(H,13,15)(H,14,16)
InChIKeyMHTWIJMKBVREII-UHFFFAOYSA-N
MW321.21 g/mol
LogP3.19
Rot. Bonds2

About 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide

3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide (PubChem CID 25225987) has the molecular formula C10H6Cl2N2O2S2 and a molecular weight of 321.21 g/mol. Its IUPAC name is 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide.

Molecular Properties

Compound Name3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide
PubChem CID25225987
Molecular FormulaC10H6Cl2N2O2S2
Molecular Weight321.21 g/mol
Exact Mass319.92
IUPAC Name3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)c1sccc1Cl)c1ccc(Cl)s1
InChIInChI=1S/C10H6Cl2N2O2S2/c11-5-3-4-17-8(5)10(16)14-13-9(15)6-1-2-7(12)18-6/h1-4H,(H,13,15)(H,14,16)
InChIKeyMHTWIJMKBVREII-UHFFFAOYSA-N
XLogP3.19
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.21
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-chloro-N'-(5-chlorothiophene-2-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 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide?
The IUPAC name of 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide (CID 25225987) is 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide.
What is the SMILES notation for 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide?
The canonical SMILES for 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide is O=C(NNC(=O)c1sccc1Cl)c1ccc(Cl)s1.
What is the InChIKey of 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide?
The InChIKey is MHTWIJMKBVREII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2O2S2/c11-5-3-4-17-8(5)10(16)14-13-9(15)6-1-2-7(12)18-6/h1-4H,(H,13,15)(H,14,16).
What are the key properties of 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide?
3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide has a molecular weight of 321.21 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N'-(5-chlorothiophene-2-carbonyl)thiophene-2-carbohydrazide is sourced from PubChem (CID 25225987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).