Compound Summary
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
Compound Information
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
Compound Name: | 1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid |
Compound CID: | 3448892 |
Synonyms: | 1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid NCGC00015432-01 Lopac-F-2927 Lopac0_000505 SCHEMBL1320560 More... |
Iupac Name: | 2-[1-[(4-fluorophenyl)methyl]-5-methoxy-2-methylindol-3-yl]acetic acid |
InChI: | InChI=1S/C19H18FNO3/c1-12-16(10-19(22)23)17-9-15(24-2)7-8-18(17)21(12)11-13-3-5-14(20)6-4-13/h3-9H,10-11H2,1-2H3,(H,22,23) |
InChIKey: | DIGWWZCEDODOMZ-UHFFFAOYSA-N |
Canonical Smiles: | CC1=C(C2=C(N1CC3=CC=C(C=C3)F)C=CC(=C2)OC)CC(=O)O |
Isomeric Smiles: | CC1=C(C2=C(N1CC3=CC=C(C=C3)F)C=CC(=C2)OC)CC(=O)O |
Molecular Weight: | 327.3 |
Molecular Formula: | C19H18FNO3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
Molecular Weight: | 327.3 |
Molecular Formula: | C19H18FNO3 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 24 |
Complexity: | 438 |
Synonyms
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
| 1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid | 1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid |
|---|---|
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid |
NCGC00015432-01 |
Lopac-F-2927 |
Lopac0_000505 |
SCHEMBL1320560 |
CHEMBL1257014 |
ZINC2507398 |
CCG-204596 |
NCGC00015432-02 |
NCGC00015432-03 |
NCGC00093904-01 |
NCGC00093904-02 |
EU-0100505 |
F 2927 |
SR-01000075875 |
SR-01000075875-1 |
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid, >=98% (HPLC), solid |
Experimental Data
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33.000000000000000 | umol/L | -12.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
Statistics Data
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -12.000000000000000 | 1 | 1 |
Statistics Data Visualization
1-(4-Fluorobenzyl)-5-methoxy-2-methylindole-3-acetic acid
