The Thieno(2,3-b)(1)benzothiophene-3-carbonitrile, 3a,8a-dihydro-2-amino-4-methoxy-7-(10-methoxy-5-methyl-4,5,6,7-tetrahydro-3H-furo(4,3,2-fg)(3)benzazocin-6-yl)-, 8,8-dioxide, with the CAS registry number 155857-53-7, is also known as AC1MINJ3. This chemical's molecular formula is C₂₆H₂₅N₃O₅S₂ and molecular weight is 523.62. What's more, its systematic name is 2-amino-4-methoxy-7-(3-methoxy-8-methyl-8,9,10,10a-tetrahydro-7H-furo[4,3,2-fg][3]benzazocin-7-yl)-3a,8a-dihydrothieno[2,3-b][1]benzothiophene-3-carbonitrile 8,8-dioxide. Its classification code is Drug / Therapeutic Agent.

Physical properties of Thieno(2,3-b)(1)benzothiophene-3-carbonitrile, 3a,8a-dihydro-2-amino-4-methoxy-7-(10-methoxy-5-methyl-4,5,6,7-tetrahydro-3H-furo(4,3,2-fg)(3)benzazocin-6-yl)-, 8,8-dioxide are: (1)ACD/LogP: 2.59; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 1.92; (4)ACD/LogD (pH 7.4): 2.57; (5)ACD/BCF (pH 5.5): 11.78; (6)ACD/BCF (pH 7.4): 52.06; (7)ACD/KOC (pH 5.5): 131.57; (8)ACD/KOC (pH 7.4): 581.53; (9)#H bond acceptors: 8; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 134.9 Å²; (13)Index of Refraction: 1.756; (14)Molar Refractivity: 135.13 cm³; (15)Molar Volume: 329.4 cm³; (16)Polarizability: 53.57×10^-24cm³; (17)Surface Tension: 63.2 dyne/cm; (18)Density: 1.58 g/cm³; (19)Flash Point: 455.4 °C; (20)Enthalpy of Vaporization: 120.54 kJ/mol; (21)Boiling Point: 829.4 °C at 760 mmHg; (22)Vapour Pressure: 1.15E-27 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1CCC2C3=C1C(C=NC=C(C3=CO2)OC)C4=C5C(=C(C=C4)OC)C6C(S5(=O)=O)SC(=C6C#N)N (2)Isomeric SMILES: CC1CCC2C3=C1C(C=N/C=C(\C3=CO2)/OC)C4=C5C(=C(C=C4)OC)C6C(S5(=O)=O)SC(= C6C#N)N
(3)InChI: InChI=1S/C26H25N3O5S2/c1-12-4-6-18-21-16(11-34-18)19(33-3)10-29-9-15(20(12)21)13-5-7-17(32-2)23-22-14(8-27)25(28)35-26(22)36(30,31)24(13)23/h5,7,9-12,15,18,22,26H,4,6,28H2,1-3H3/b19-10+,29-9?
(4)InChIKey: IUWIKAGIDRISDX-LKYXUNLSSA-N

The toxicity data is as follows: