878739-06-1

Name AZ 628
CAS 878739-06-1
Molecular Formula C27H25N5O2
MDL Number MFCD17392577
Molecular Weight 451.52
MOL File 878739-06-1.mol

Chemical Properties

density  1.21±0.1 g/cm3(Predicted)
storage temp.  ?20°C
solubility  DMSO: soluble10mg/mL, clear
form  powder
pka 12.92±0.70(Predicted)
color  white to beige
InChI 1S/C27H25N5O2/c1-17-8-9-21(31-25(33)18-6-5-7-19(12-18)27(2,3)15-28)14-24(17)30-20-10-11-23-22(13-20)26(34)32(4)16-29-23/h5-14,16,30H,1-4H3,(H,31,33)
InChIKey ZGBGPEDJXCYQPH-UHFFFAOYSA-N
SMILES [n]1([c](c2c(nc1)ccc(c2)Nc3c(ccc(c3)NC(=O)c4cc(ccc4)C(C)(C)C#N)C)=O)C

Safety Data

Hazard Codes  T
Risk Statements 
Safety Statements 
RIDADR  UN 2811 6.1 / PGIII
WGK Germany  3
HS Code  2922500090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

Spectrum Detail

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