Loading ...
Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »

P-502365885

Product Show structure
In order to add this molecule to a collection you have to create an account.   Sign up for free
  1. InChIKey:
  2. SMILES:
  3. Formula:
  1. Get quote for multiple compounds
  2. Get custom quote


Name File
SDF P-502365885.sdf
SMILES P-502365885.smiles
Standard InChI P-502365885.inchi
InChIKey P-502365885.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-502365885 TimTec Building Block Collection 90 in stock
Property Value
Components 1
Mass 252.342
logP 1.37918
H-bond acceptors 6
H-bond donors 3
Rotatable bonds 7
PSA 114.19
RO5 violations 0
RO3 violations 3
Refractivity 69.1831
Atoms 33
Rings 1
Heavy atoms 17
Hydrogen atoms 16
Heteroatoms 7
N/O atoms 6
Inorganic atoms 0
Halogen atoms 0
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 1
Cis/trans stereo double bonds 1
Unknown stereo double bonds 0
Undefined stereo double bonds 0
loader