Compound Summary
503431-81-0
Compound Information
503431-81-0
Compound Name: | 503431-81-0 |
Compound CID: | 10013505 |
Synonyms: | 503431-81-0 NGX-267 (2S)-2-ETHYL-8-METHYL-1-THIA-4,8-DIAZASPIRO4,5DECAN-3-ONE AF267B NGX267 More... |
Iupac Name: | (2S)-2-ethyl-8-methyl-1-thia-4,8-diazaspiro[4.5]decan-3-one |
InChI: | InChI=1S/C10H18N2OS/c1-3-8-9(13)11-10(14-8)4-6-12(2)7-5-10/h8H,3-7H2,1-2H3,(H,11,13)/t8-/m0/s1 |
InChIKey: | PHOZOHFUXHPOCK-QMMMGPOBSA-N |
Canonical Smiles: | CCC1C(=O)NC2(S1)CCN(CC2)C |
Isomeric Smiles: | CC[C@H]1C(=O)NC2(S1)CCN(CC2)C |
Molecular Weight: | 214.33 |
Molecular Formula: | C10H18N2OS |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
503431-81-0
Molecular Weight: | 214.33 |
Molecular Formula: | C10H18N2OS |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 3 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 14 |
Complexity: | 236 |
Synonyms
503431-81-0
| 503431-81-0 | 503431-81-0 |
|---|---|
503431-81-0 |
NGX-267 |
(2S)-2-ETHYL-8-METHYL-1-THIA-4,8-DIAZASPIRO4,5DECAN-3-ONE |
AF267B |
NGX267 |
(S)-2-Ethyl-8-methyl-1-thia-4,8-diazaspiro4.5decan-3-one |
AF 267B |
UNII-8D3PZX7G73 |
AF-267B |
NGX 267 |
8D3PZX7G73 |
503431-81-0 (free base) |
SCHEMBL3651146 |
CHEMBL4297408 |
DTXSID40198399 |
MFCD09265248 |
ZINC13816318 |
AKOS025295388 |
DB05152 |
NCGC00162382-01 |
DS-019214 |
C90302 |
Q27270207 |
(S)-2-Ethyl-8-methyl-1-thia-4,8-diaza-spiro4.5decan-3-one |
(2S)-2-ETHYL-8-METHYL-1-THIA-4,8-DIAZASPIRO4.5DECAN-3-ONE |
1-Thia-4,8-diazaspiro(4.5)decan-3-one, 2-ethyl-8-methyl-, (2S)- |
Experimental Data
503431-81-0
| 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 | -4.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
503431-81-0
Statistics Data
503431-81-0
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -4.000000000000000 | 1 | 1 |
Statistics Data Visualization
503431-81-0
