Compound Summary


5186223
  Compound Information
 5186223

Compound Name:

5186223

Compound CID:

5186223

Synonyms:

AKOS003873422









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Iupac Name:

propyl 2-(propanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

InChI:

InChI=1S/C16H23NO3S/c1-3-10-20-16(19)14-11-8-6-5-7-9-12(11)21-15(14)17-13(18)4-2/h3-10H2,1-2H3,(H,17,18)

InChIKey:

SJCUYVLVIVHYMD-UHFFFAOYSA-N

Canonical Smiles:

CCCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CC

Isomeric Smiles:

CCCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CC

Molecular Weight:

309.4

Molecular Formula:

C16H23NO3S

  Compound Structure
 2D Structure:
 3D Structure:
  Computed Properties
 5186223

Molecular Weight:

309.4

Molecular Formula:

C16H23NO3S

Hydrogen Bond Donor Count:

1

Hydrogen Bond Acceptor Count:

4

Rotatable Bond Count:

6

Heavy Atom Count:

21

Complexity:

375

  Synonyms
 5186223

5186223 5186223

AKOS003873422

  Experimental Data
 5186223

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 50.000000000000000 umol/L -0.970000000000000 NS N2 30970250 Inactive
  Experimental Data Visualization
 5186223

  Statistics Data
 5186223

Species Avg/Med Lifespan Change(%) Max Lifespan Change(%) Count Reference Count Data point
Caenorhabditis elegans -0.970000000000000 1 1
  Statistics Data Visualization
 5186223