N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide

C11H7Br2N3O2S — CID 9330718

IUPACN'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide
SMILESO=C(NNC(=O)c1cc(Br)c(Br)s1)c1ccccn1
InChIInChI=1S/C11H7Br2N3O2S/c12-6-5-8(19-9(6)13)11(18)16-15-10(17)7-3-1-2-4-14-7/h1-5H,(H,15,17)(H,16,18)
InChIKeyJXCXPELBMDMNSA-UHFFFAOYSA-N
MW405.07 g/mol
LogP2.74
Rot. Bonds2

About N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide

N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide (PubChem CID 9330718) has the molecular formula C11H7Br2N3O2S and a molecular weight of 405.07 g/mol. Its IUPAC name is N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide.

Molecular Properties

Compound NameN'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide
PubChem CID9330718
Molecular FormulaC11H7Br2N3O2S
Molecular Weight405.07 g/mol
Exact Mass402.86
IUPAC NameN'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide
SMILESO=C(NNC(=O)c1cc(Br)c(Br)s1)c1ccccn1
InChIInChI=1S/C11H7Br2N3O2S/c12-6-5-8(19-9(6)13)11(18)16-15-10(17)7-3-1-2-4-14-7/h1-5H,(H,15,17)(H,16,18)
InChIKeyJXCXPELBMDMNSA-UHFFFAOYSA-N
XLogP2.74
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.07
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(4,5-dibromothiophene-2-carbonyl)pyridine-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

Related Compounds

N'-(2-bromobenzoyl)pyridine-2-carbohydrazide
CID 26533733
1-amino-3-(pyridine-2-carbonylamino)urea
CID 175507593
N'-(7-bromo-1-benzofuran-2-carbonyl)pyridine-2-carbohydrazide
CID 39706116
N'-(5-bromo-2-fluorobenzoyl)pyridine-2-carbohydrazide
CID 9331928
N'-(pyridine-4-carbonyl)pyridine-2-carbohydrazide
CID 3977689
4,5-dibromo-N-(5-chloroquinolin-8-yl)thiophene-2-carboxamide
CID 78915812
N'-[1-(4-bromophenyl)ethenyl]pyridine-2-carbohydrazide
CID 3448394
4,5-dibromo-N-(1H-pyrazol-5-yl)thiophene-2-carboxamide
CID 61393424
N-(2-bromo-5-chlorophenyl)pyridine-2-carboxamide
CID 81271946
4,5-dibromo-N'-(4-ethylbenzoyl)thiophene-2-carbohydrazide
CID 18291485
methyl 2-oxo-2-[2-(pyridine-2-carbonyl)hydrazinyl]acetate
CID 58366262
N'-(2-fluorobenzoyl)pyridine-2-carbohydrazide
CID 27661912

Frequently Asked Questions

What is the IUPAC name of N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide?
The IUPAC name of N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide (CID 9330718) is N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide.
What is the SMILES notation for N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide?
The canonical SMILES for N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide is O=C(NNC(=O)c1cc(Br)c(Br)s1)c1ccccn1.
What is the InChIKey of N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide?
The InChIKey is JXCXPELBMDMNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br2N3O2S/c12-6-5-8(19-9(6)13)11(18)16-15-10(17)7-3-1-2-4-14-7/h1-5H,(H,15,17)(H,16,18).
What are the key properties of N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide?
N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide has a molecular weight of 405.07 g/mol, XLogP of 2.74, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4,5-dibromothiophene-2-carbonyl)pyridine-2-carbohydrazide is sourced from PubChem (CID 9330718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).