Compound Summary
O27
Compound Information
O27
Compound Name: | O27 |
Compound CID: | 46870037 |
Synonyms: | O27 More... |
Iupac Name: | N-[(3R)-pyrrolidin-3-yl]-2-[[2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetyl]amino]-5,6,7,7a-tetrahydro-1-benzothiophene-3-carboxamide |
InChI: | InChI=1S/C23H28F3N5O2S/c24-23(25,26)20-14-5-1-3-7-16(14)31(30-20)12-18(32)29-22-19(15-6-2-4-8-17(15)34-22)21(33)28-13-9-10-27-11-13/h6,13,17,27H,1-5,7-12H2,(H,28,33)(H,29,32)/t13-,17?/m1/s1 |
InChIKey: | POWUQMZBRQWJNU-FWJOYPJLSA-N |
Canonical Smiles: | C1CCC2=C(C1)C(=NN2CC(=O)NC3=C(C4=CCCCC4S3)C(=O)NC5CCNC5)C(F)(F)F |
Isomeric Smiles: | C1CCC2=C(C1)C(=NN2CC(=O)NC3=C(C4=CCCCC4S3)C(=O)N[C@@H]5CCNC5)C(F)(F)F |
Molecular Weight: | 495.6 |
Molecular Formula: | C23H28F3N5O2S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
O27
Molecular Weight: | 495.6 |
Molecular Formula: | C23H28F3N5O2S |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 8 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 34 |
Complexity: | 892 |
Synonyms
O27
| O27 | O27 |
|---|---|
O27 |
Experimental Data
O27
| 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 | 60.000000000000000 | umol/L | 22.500000000000000 | 14.600000000000000 | -35.100000000000000 | S | N2 | 31879284 | Inactive |
Experimental Data Visualization
O27
Statistics Data
O27
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -35.100000000000000 | 1 | 1 |
Statistics Data Visualization
O27
