Identification Chemical Properties Supplier

853695-44-0

Name Acetamide, 2-[(3-chloro-4-fluorophenyl)amino]-N-[4-(1-piperidinylsulfonyl)phenyl]-
CAS 853695-44-0
Molecular Formula C19H21ClFN3O3S
Molecular Weight 425.9
MOL File 853695-44-0.mol
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Chemical Properties

density  1.429±0.06 g/cm3(Predicted)
pka 13.28±0.70(Predicted)
InChI InChI=1S/C19H21ClFN3O3S/c20-17-12-15(6-9-18(17)21)22-13-19(25)23-14-4-7-16(8-5-14)28(26,27)24-10-2-1-3-11-24/h4-9,12,22H,1-3,10-11,13H2,(H,23,25)
InChIKey VXFKIHSAOLPRJD-UHFFFAOYSA-N
SMILES C(NC1=CC=C(S(N2CCCCC2)(=O)=O)C=C1)(=O)CNC1=CC=C(F)C(Cl)=C1

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