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4-(7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine

HCID 44397192
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
607370-99-0
Standard SMILES
CCn1c(-c2nonc2N)nc2cncc(Br)c21
InChIKey
FNMHGQSBPQSGMV-UHFFFAOYSA-N
Molecular formula
C10H9BrN6O
Average molar mass
309.12 g/mol
Monoisotopic mass
308.00212

Names & identifiers

Preferred name
4-(7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine
IUPAC
4-(7-bromo-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine
English name
4-(7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)-furazan-3-ylamine
Molecular formula
C10H9BrN6O
Molecular weight
309.12

Names & synonyms

607370-99-04-(7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amineMFCD267436724-{7-bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl}-1,2,5-oxadiazol-3-amineC10H9BrN6O4-(7-bromo-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amineCHEMBL3658324-(7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)-furazan-3-ylamineSCHEMBL4720745DTXSID70658734FNMHGQSBPQSGMV-UHFFFAOYSA-NBDBM50168867
Show more names
1,2,5-Oxadiazol-3-amine, 4-(7-bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)-
AKOS022170548SS-4759SY311328SB-738004CS-0454075F707504-(7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridin-2-yl)furazan-3-ylamine

Database identifiers

CAS
607370-99-0
PubChem CID
44397192
DTXSID
DTXSID70658734
ChEMBL
CHEMBL365832

Properties

Computed structural propertiesFilling in

XLogP
0.5
Topological polar surface area
95.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
308

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
HS Code
2933399990 · 2933399990

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
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Related reactions

15 records
New reaction record
HRID 151154 reaction equation
HRID 151154As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 183217 reaction equation
HRID 183217As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 671046 reaction equation
HRID 671046As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 689482 reaction equation
HRID 689482As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 951979 reaction equation
HRID 951979As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1136017 reaction equation
HRID 1136017As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1394188 reaction equation
HRID 1394188As productuspto-grants-2008_03
HRID 1394189 reaction equation
HRID 1394189As reactantuspto-grants-2008_03
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Compound notes

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