Compound Summary
Compound Information
calmidazolium chloride
Compound Name: | calmidazolium chloride |
Compound CID: | 644274 |
Synonyms: | calmidazolium chloride 57265-65-3 R 24571 MFCD00077679 1-bis(4-Chlorophenyl)methyl-3-2-(2,4-dichlorophenyl)-2-(2,4-dichlorobenzyloxy)ethyl-1H-imidazolium chloride More... |
Iupac Name: | 1-[bis(4-chlorophenyl)methyl]-3-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]imidazol-3-ium;chloride |
InChI: | InChI=1S/C31H23Cl6N2O.ClH/c32-23-6-1-20(2-7-23)31(21-3-8-24(33)9-4-21)39-14-13-38(19-39)17-30(27-12-11-26(35)16-29(27)37)40-18-22-5-10-25(34)15-28(22)36;/h1-16,19,30-31H,17-18H2;1H/q+1;/p-1 |
InChIKey: | YGEIMSMISRCBFF-UHFFFAOYSA-M |
Canonical Smiles: | C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)N3C=C[N+](=C3)CC(C4=C(C=C(C=C4)Cl)Cl)OCC5=C(C=C(C=C5)Cl)Cl)Cl.[Cl-] |
Isomeric Smiles: | C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)N3C=C[N+](=C3)CC(C4=C(C=C(C=C4)Cl)Cl)OCC5=C(C=C(C=C5)Cl)Cl)Cl.[Cl-] |
Molecular Weight: | 687.7 |
Molecular Formula: | C31H23Cl7N2O |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
calmidazolium chloride
Molecular Weight: | 687.7 |
Molecular Formula: | C31H23Cl7N2O |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 2 |
Rotatable Bond Count: | 9 |
Heavy Atom Count: | 41 |
Complexity: | 742 |
Synonyms
calmidazolium chloride
| calmidazolium chloride | calmidazolium chloride |
|---|---|
calmidazolium chloride |
57265-65-3 |
R 24571 |
MFCD00077679 |
1-bis(4-Chlorophenyl)methyl-3-2-(2,4-dichlorophenyl)-2-(2,4-dichlorobenzyloxy)ethyl-1H-imidazolium chloride |
1-bis(4-chlorophenyl)methyl-3-2-(2,4-dichlorophenyl)-2-(2,4-dichlorophenyl)methoxyethylimidazol-3-ium;chloride |
MLS002172477 |
CHEMBL1208858 |
SMR001254103 |
SR-01000075486 |
R-24571 |
R 24571 chloride |
methoxyethyl-, chloride |
Calmidazolium chloride, solid |
1-(Bis(chlorophenyl)methyl)-3-(2,4-dichloro-beta-(2,4-dichlorobenzyloxy)phenethyl)imidazolinium chloride |
C31H23Cl7N2O |
MLS006010820 |
SCHEMBL1020756 |
AOB2162 |
DTXSID501017259 |
HMS2230P23 |
HMS3260H06 |
HMS3269B13 |
HMS3372E22 |
Calmidazolium chloride (R 24571) |
Tox21_500272 |
AKOS024457168 |
CCG-221576 |
LP00272 |
NCGC00093729-01 |
NCGC00093729-02 |
NCGC00260957-01 |
1H-Imidazolium, 1-(bis(4-chlorophenyl)methyl)-3-(2-(2,4-dichlorophenyl)-2-((2,4-dichlorophenyl)methoxy)ethyl)-, chloride |
SMR004701750 |
HY-103319 |
CS-0027612 |
EU-0100272 |
Calmidazolium Chloride - CAS 57265-65-3 |
C 3930 |
SR-01000075486-1 |
SR-01000075486-5 |
Q27270198 |
1-bis(p-Chlorophenyl)methyl-3-2,4-dichloro-beta-(2,4-dichlorobenzyloxy)phenethyl |
1-Bis(4-chlorophenyl)methyl-3-2,4-dichloro-beta-(2,4-dichlorobenzyloxy)phenethylimidazolium chloride |
1-Bis(4-chlorophenyl)methyl-3-2- (2,4-dichlorophenyl)-2-(2,4-dichlorobenzyloxy)ethyl-1H-imidazolium chloride |
1H-imidazolium, 3-bis(4-chlorophenyl)methyl-1-2-(2,4-dichlorophenyl)-2-(2,4-dichlorophenyl) |
Experimental Data
calmidazolium chloride
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | -21 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
calmidazolium chloride
Statistics Data
calmidazolium chloride
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -21 | 1 | 1 |
Statistics Data Visualization
calmidazolium chloride
