The 5,8,11,14-Eicosatetraenamide,N-(4-hydroxyphenyl)-, (5Z,8Z,11Z,14Z)- with CAS registry number of 183718-77-6 is also known as AM 404. The systematic name is (5Z,8Z,11Z,14Z)-N-(4-Hydroxyphenyl)icosa-5,8,11,14-tetraenamide. In addition, the formula is C26H37NO2 and the molecular weight is 395.58. What's more, this chemical is used as a metabolite of the well-known analgesic paracetamol and it is originally reported to be an endogenous cannabinoid reuptake inhibitor.
Physical properties about 5,8,11,14-Eicosatetraenamide,N-(4-hydroxyphenyl)-, (5Z,8Z,11Z,14Z)- are: (1)ACD/LogP: 7.63; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.63; (4)ACD/LogD (pH 7.4): 7.63; (5)ACD/BCF (pH 5.5): 368773; (6)ACD/BCF (pH 7.4): 367896.63; (7)ACD/KOC (pH 5.5): 335929; (8)ACD/KOC (pH 7.4): 335130.69; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 16; (12)Index of Refraction: 1.555; (13)Molar Refractivity: 126.02 cm3; (14)Molar Volume: 392.5 cm3; (15)Surface Tension: 40.6 dyne/cm; (16)Density: 1.007 g/cm3; (17)Flash Point: 304.2 °C; (18)Enthalpy of Vaporization: 89.91 kJ/mol; (19)Boiling Point: 579.4 °C at 760 mmHg; (20)Vapour Pressure: 5.02E-14 mmHg at 25 °C.
When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. Besides, it is highly flammable. During using it, keep away from sources of ignition and also keep container tightly closed.
You can still convert the following datas into molecular structure:
1. SMILES: O=C(Nc1ccc(O)cc1)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC
2. InChI: InChI=1/C26H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)27-24-20-22-25(28)23-21-24/h6-7,9-10,12-13,15-16,20-23,28H,2-5,8,11,14,17-19H2,1H3,(H,27,29)/b7-6-,10-9-,13-12-,16-15-
3. InChIKey: IJBZOOZRAXHERC-DOFZRALJBG
4. Std. InChI: InChI=1S/C26H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)27-24-20-22-25(28)23-21-24/h6-7,9-10,12-13,15-16,20-23,28H,2-5,8,11,14,17-19H2,1H3,(H,27,29)/b7-6-,10-9-,13-12-,16-15-
5. Std. InChIKey: IJBZOOZRAXHERC-DOFZRALJSA-N
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