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(E)-3-(4,5-diphenyl-1H-imidazol-1-yl)-N'-(furan-2-ylmethylene)propanehydrazide

HCID 9619656
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Basic information

CAS
315248-09-0
Standard SMILES
O=C(CCn1cnc(-c2ccccc2)c1-c1ccccc1)N/N=C/c1ccco1
InChIKey
JFBWPOHFKZTWOX-UHFFFAOYSA-N
Molecular formula
C23H20N4O2
Average molar mass
384.4 g/mol
Monoisotopic mass
384.15862589

Names & identifiers

Preferred name
(E)-3-(4,5-diphenyl-1H-imidazol-1-yl)-N'-(furan-2-ylmethylene)propanehydrazide
IUPAC
3-(4,5-diphenylimidazol-1-yl)-N-[(E)-furan-2-ylmethylideneamino]propanamide
English name
(E)-3-(4,5-diphenyl-1H-imidazol-1-yl)-N-(furan-2-ylmethylene)propanehydrazide
Molecular formula
C23H20N4O2
Molecular weight
384.43

Names & synonyms

315248-09-03-(4,5-Diphenyl-imidazol-1-yl)-propionic acid furan-2-ylmethylene-hydrazide(E)-3-(4,5-diphenyl-1H-imidazol-1-yl)-N'-(furan-2-ylmethylene)propanehydrazideF1021-00403-(4,5-diphenyl-1H-imidazol-1-yl)-N'-[(E)-furan-2-ylmethylidene]propanehydrazideSMSSF-0062998ZINC4467500MFCD02328828STK106839AKOS002328557ZINC000001469536ST50784925
Show more names
3-(4,5-DIPHENYL-1H-IMIDAZOL-1-YL)-N'-(2-FURYLMETHYLENE)PROPANOHYDRAZIDE3-(4,5-DIPHENYL-1H-IMIDAZOL-1-YL)-N'-(2-FURYLMETHYLENE)PROPANOHYDRAZIDE(E)-3-(4,5-diphenyl-1H-imidazol-1-yl)-N-(furan-2-ylmethylene)propanehydrazide1H-Imidazole-1-propanoic acid, 4,5-diphenyl-, 2-(2-furanylmethylene)hydrazide
AB00685450-01O=C(CCn1cnc(c1c1ccccc1)c1ccccc1)NN=Cc1ccco1(E)3(45diphenyl1Himidazol1yl)N(furan2ylmethylene)propanehydrazide3(45diphenylimidazol1yl)N((E)furan2ylmethylideneamino)propanamideN((1E)2(2FURYL)1AZAVINYL)3(45DIPHENYLIMIDAZOLYL)PROPANAMIDE3(45DIPHENYL1HIMIDAZOL1YL)N((E)FURAN2YLMETHYLIDENE)PROPANEHYDRAZIDEC1=CC=C(C=C1)C2=C(N(C=N2)CCC(=O)NN=CC3=CC=CO3)C4=CC=CC=C4N-((1E)-2-(2-furyl)-1-azavinyl)-3-(4,5-diphenylimidazolyl)propanamide

Database identifiers

CAS
315248-09-0
PubChem CID
9619656
EC Number
120-538-0

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
72.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
29
Formal charge
0
Complexity
543

Physicochemical properties

Density
1.21 · 1.21±0.1 g/cm3(Predicted)
pka
13.18 · 13.18±0.46(Predicted)

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Related reactions

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Compound notes

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