This chemical is called N6-Cyclopentyladenosine, and its systematic name is N-cyclopentyladenosine. With the molecular formula of C15H21N5O4, its molecular weight is 335.36. The CAS registry number of this chemical is 41552-82-3. Additionally, its product category is Adenosine Receptor. It should be stored at 2-8°C.
Other characteristics of the chemical can be summarised as followings: (1)ACD/LogP: 1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.98; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3.22; (6)ACD/BCF (pH 7.4): 3.38; (7)ACD/KOC (pH 5.5): 79.18; (8)ACD/KOC (pH 7.4): 83.23; (9)#H bond acceptors: 9; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 83.76 Å2; (13)Index of Refraction: 1.816; (14)Molar Refractivity: 81.59 cm3; (15)Molar Volume: 187.9 cm3; (16)Polarizability: 32.34×10-24cm3; (17)Surface Tension: 80.8 dyne/cm; (18)Density: 1.78 g/cm3; (19)Flash Point: 361.1 °C; (20)Enthalpy of Vaporization: 103.9 kJ/mol; (21)Boiling Point: 673.4 °C at 760 mmHg; (22)Vapour Pressure: 4.71E-19 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: n3c1c(ncnc1NC2CCCC2)n(c3)[C@@H]4O[C@@H]([C@@H](O)[C@H]4O)CO
2.InChI: InChI=1/C15H21N5O4/c21-5-9-11(22)12(23)15(24-9)20-7-18-10-13(16-6-17-14(10)20)19-8-3-1-2-4-8/h6-9,11-12,15,21-23H,1-5H2,(H,16,17,19)/t9-,11-,12-,15-/m1/s1
3.InChIKey: SQMWSBKSHWARHU-SDBHATREBV
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