IUPAC Name :(2S)-N-[(2Z,6S,9S,10R)-6-[(2S)-butan-2-yl]-5,8-dioxo-10-phenyl-11-oxa-4,7-diazabicyclo[10.2.2]hexadeca-1(14),2,12,15-tetraen-9-yl]-2-(dimethylamino)-3-phenylpropanamide
InChI :InChI=1/C34H40N4O4/c1-5-23(2)29-33(40)35-21-20-24-16-18-27(19-17-24)42-31(26-14-10-7-11-15-26)30(34(41)36-29)37-32(39)28(38(3)4)22-25-12-8-6-9-13-25/h6-21,23,28-31H,5,22H2,1-4H3,(H,35,40)(H,36,41)(H,37,39)/b21-20-/t23-,28-,29-,30-,31+/m0/s1
Std.InChI: InChI=1S/C34H40N4O4/c1-5-23(2)29-33(40)35-21-20-24-16-18-27(19-17-24)42-31(26-14-10-7-11-15-26)30(34(41)36-29)37-32(39)28(38(3)4)22-25-12-8-6-9-13-25/h6-21,23,28-31H,5,22H2,1-4H3,(H,35,40)(H,36,41)(H,37,39)/b21-20-/t23-,28-,29-,30-,31+/m0/s1
InChIKey :GVFKEVFAPIUOAI-ONQAJXPKBJ
Std.InChIKey: GVFKEVFAPIUOAI-ONQAJXPKSA-N
SMILES :CC[C@H](C)[C@H]1C(=O)N/C=C\C2=CC=C(C=C2)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](CC3=CC=CC=C3)N(C)C)C4=CC=CC=C4
Molar Refractivity :165.37 ± 0.5 cm3 (est)
Parachor :1247.4 ± 8.0 cm3 (est)
Index of Refraction :1.598 ± 0.05
(est)
Surface Tension :43.8 ± 7.0 dyne/cm (est)
Density :1.17 ± 0.1 g/cm3 (est)
Polarizability :65.55 ± 0.5 10-24cm3 (est)