IUPAC Name :7-tert-butyl-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]-2H-chromene-3-carboxamide
InChI :InChI=1/C22H25FN2O4S/c1-22(2,3)17-7-6-15-10-16(13-29-20(15)11-17)21(26)24-12-14-5-8-19(18(23)9-14)25-30(4,27)28/h5-11,25H,12-13H2,1-4H3,(H,24,26)
Std.InChI: InChI=1S/C22H25FN2O4S/c1-22(2,3)17-7-6-15-10-16(13-29-20(15)11-17)21(26)24-12-14-5-8-19(18(23)9-14)25-30(4,27)28/h5-11,25H,12-13H2,1-4H3,(H,24,26)
InChIKey :OKFWUVPTFAUPEY-UHFFFAOYAT
Std.InChIKey: OKFWUVPTFAUPEY-UHFFFAOYSA-N
SMILES :CC(C)(C)C1=CC2=C(C=C1)C=C(CO2)C(=O)NCC3=CC(=C(C=C3)NS(=O)(=O)C)F
Molar Refractivity :113.48 ± 0.4 cm3 (est)
Parachor :892.4 ± 6.0 cm3 (est)
Index of Refraction :1.602 ± 0.02
(est)
Surface Tension :53.0 ± 3.0 dyne/cm (est)
Density :1.307 ± 0.06 g/cm3 (est)
Polarizability :44.99 ± 0.5 10-24cm3 (est)