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Hydracarbazine

HCID 71653
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3614-47-9
Standard SMILES
NNc1ccc(C(N)=O)nn1
InChIKey
WRYZEGZNBYOMLE-UHFFFAOYSA-N
Molecular formula
C5H7N5O
Average molar mass
153.14 g/mol
Monoisotopic mass
153.06505986

Overview

Hydracarbazine is a heteroarene and an aromatic amide.

Names & identifiers

Preferred name
Hydracarbazine
IUPAC
6-hydrazinylpyridazine-3-carboxamide
English name
hydracarbazine
Molecular formula
C5H7N5O
Molecular weight
153.14

Names & synonyms

Hydracarbazine3614-47-96-hydrazinylpyridazine-3-carboxamideHidracarbazinaHydracarbazinum6-Hydrazino-3-pyridazinecarboxamideTH-2151Hydracarbazine [INN:DCF]UNII-6CTK2FB9QM6CTK2FB9QMHydracarbazinum [INN-Latin]Hidracarbazina [INN-Spanish]
Show more names
6-hydrazinopyridazine-3-carboxamide3-Pyridazinecarboxamide, 6-hydrazinyl-6-hydrazinylidene-1,6-dihydropyridazine-3-carboxamide
EINECS 222-788-7HYDRACARBAZINE [MI]HYDRACARBAZINE [INN]HYDRACARBAZINE [WHO-DD]DTXSID30189716Hydracarbazinum (INN-Latin)Hidracarbazina (INN-Spanish)RefChem:146978

Database identifiers

CAS
3614-47-9
PubChem CID
71653
DTXSID
DTXSID30189716
ChEMBL
CHEMBL2106246
ChEBI
CHEBI:136055
UNII
6CTK2FB9QM
EC Number
222-788-7
Nikkaji
J9.581H

Properties

Computed structural properties

XLogP
-1.4
Topological polar surface area
107 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
150

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15

Physicochemical properties

Melting point
249 · 249-250 °C (decomp)
Boiling point
361.8 · 361.8±25.0 °C(Predicted)
Density
1.71 · 1.71±0.1 g/cm3(Predicted)
pka
12.21 · 12.21±0.20(Predicted)
FDA UNII
6 CTK2FB9QM · 6CTK2FB9QM
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
HS Code
2933998090 · 2933998090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2933998090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P280-P301+P312-P302+P352-P305+P351+P338

Chemistry & industry

Pharmacology

PharmacodynamicsRelaxes vascular smooth muscle.
Mechanism of ActionLikely acts similarly to hydralazine, a related compound, which interferes with calcium release from the sarcoplasmic reticulum in response to inositol.

Applications

UsesHydracarbazine is a pyridazine. Hydracarbazine can effectively lower blood pressure, it can be used for the research of high blood pressure[1][2].

Additional notes

DefinitionChEBI: Hydracarbazine is a heteroarene and an aromatic amide.

Related reactions

1 records
New reaction record
HRID 27900 reaction equation
HRID 27900As reactantuspto-grants-1980_09

Compound notes

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