Compound Summary
Compound Information
BRL 37344 sodium
Compound Name: | BRL 37344 sodium |
Compound CID: | 2436 |
Synonyms: | BRL 37344 sodium 127299-93-8 BRL 37344 (sodium) Brl 37344A Acetic acid, 2-4-(2S)-2-(2S)-2-(3-chlorophenyl)-2-hydroxyethylaminopropylphenoxy-, sodium salt (1:1), rel- More... |
Iupac Name: | sodium;2-[4-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]phenoxy]acetate |
InChI: | InChI=1S/C19H22ClNO4.Na/c1-13(21-11-18(22)15-3-2-4-16(20)10-15)9-14-5-7-17(8-6-14)25-12-19(23)24;/h2-8,10,13,18,21-22H,9,11-12H2,1H3,(H,23,24);/q;+1/p-1 |
InChIKey: | SNJIJYKMYQRHRC-UHFFFAOYSA-M |
Canonical Smiles: | CC(CC1=CC=C(C=C1)OCC(=O)[O-])NCC(C2=CC(=CC=C2)Cl)O.[Na+] |
Isomeric Smiles: | CC(CC1=CC=C(C=C1)OCC(=O)[O-])NCC(C2=CC(=CC=C2)Cl)O.[Na+] |
Molecular Weight: | 385.8 |
Molecular Formula: | C19H21ClNNaO4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
BRL 37344 sodium
Molecular Weight: | 385.8 |
Molecular Formula: | C19H21ClNNaO4 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 9 |
Heavy Atom Count: | 26 |
Complexity: | 407 |
Synonyms
BRL 37344 sodium
| BRL 37344 sodium | BRL 37344 sodium |
|---|---|
BRL 37344 sodium |
127299-93-8 |
BRL 37344 (sodium) |
Brl 37344A |
Acetic acid, 2-4-(2S)-2-(2S)-2-(3-chlorophenyl)-2-hydroxyethylaminopropylphenoxy-, sodium salt (1:1), rel- |
BRL 37344 sodium salt |
CHEMBL1445411 |
SCHEMBL22729973 |
HMS3260H15 |
HMS3675J22 |
BCP27811 |
Tox21_500197 |
AKOS025294254 |
CCG-204292 |
LP00197 |
SDCCGSBI-0050185.P002 |
aminopropylphenoxy-acetic acid sodium |
NCGC00015133-02 |
NCGC00015133-03 |
NCGC00015133-04 |
NCGC00093673-01 |
NCGC00093673-02 |
NCGC00260882-01 |
B-169 |
EU-0100197 |
J-005478 |
BRL37344 sodium; BRL 37344 sodium;BRL 37344 sodium salt |
( inverted question mark)-(R*,R*)-4-2-2-(3-Chlorophenyl)-2-hydroxyethyl |
Experimental Data
BRL 37344 sodium
| 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 | -8 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
BRL 37344 sodium
Statistics Data
BRL 37344 sodium
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -8 | 1 | 1 |
Statistics Data Visualization
BRL 37344 sodium
