Chemical Property of Unii-80R2QB53DN
Chemical Property:
- PSA：367.18000
- LogP:7.59160
- Hydrogen Bond Donor Count:5
- Hydrogen Bond Acceptor Count:21
- Rotatable Bond Count:9
- Exact Mass:962.923715
- Heavy Atom Count:60
- Complexity:1810
- Purity/Quality:
-
99% *data from raw suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CNC1=NC(=NC(=N1)NC2=CC(=CC3=C2C(=O)C(=NNC4=CC=CC=C4S(=O)(=O)[O-])C(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])NC5=CC=CC(=C5)NC6=C(C(=NC(=N6)Cl)Cl)Cl.[Na+].[Na+].[Na+]
- Isomeric SMILES:CNC1=NC(=NC(=N1)NC2=CC(=CC3=C2C(=O)/C(=N\NC4=CC=CC=C4S(=O)(=O)[O-])/C(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])NC5=CC=CC(=C5)NC6=C(C(=NC(=N6)Cl)Cl)Cl.[Na+].[Na+].[Na+]
