CAS: | 913611-97-9 |
MF: | C25H27N3O2S |
MW: | 433.57 |
EINECS: | 811-628-7 |
Product Categories: | Dopamine D2 receptor partial agonist;API;Inhibitors;913611-97-9 |
Mol File: | 913611-97-9.mol |
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Brexpiprazole Chemical Properties |
Melting point | 179 - 181oC |
Boiling point | 675.2±55.0 °C(Predicted) |
density | 1.245±0.06 g/cm3(Predicted) |
storage temp. | Refrigerator |
solubility | Dichloromethane (Slightly), Chloroform (Slightly), Methanol (Slightly) |
pka | 11.22±0.70(Predicted) |
form | Solid |
color | White to Off-White |
InChI | InChI=1S/C25H27N3O2S/c29-25-9-7-19-6-8-20(18-22(19)26-25)30-16-2-1-11-27-12-14-28(15-13-27)23-4-3-5-24-21(23)10-17-31-24/h3-10,17-18H,1-2,11-16H2,(H,26,29) |
InChIKey | ZKIAIYBUSXZPLP-UHFFFAOYSA-N |
SMILES | N1C2=C(C=CC(OCCCCN3CCN(C4=C5C=CSC5=CC=C4)CC3)=C2)C=CC1=O |
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