Product Name

6H-Imidazo[4,5,1-de]acridin-6-one,5-[[3-(diethylamino)propyl]amino]-8-hydroxy- Specification

The 6H-Imidazo[4,5,1-de]acridin-6-one,5-[[3-(diethylamino)propyl]amino]-8-hydroxy- is an organic compound with the formula C21H24N4O2. With the CAS registry number 138154-43-5, the systematic name of this chemical is 5-{[3-(diethylamino)propyl]amino}-8-hydroxy-6H-imidazo[4,5,1-de]acridin-6-one.

Physical properties about 6H-Imidazo[4,5,1-de]acridin-6-one,5-[[3-(diethylamino)propyl]amino]-8-hydroxy- are: (1)ACD/LogP: 3.25; (2)#H bond acceptors: 6; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 8; (5)Polar Surface Area: 50.6 Å2; (6)Index of Refraction: 1.668; (7)Molar Refractivity: 104.48 cm3; (8)Molar Volume: 280.3 cm3; (9)Polarizability: 41.42×10-24cm3; (10)Surface Tension: 51.2 dyne/cm; (11)Density: 1.3 g/cm3; (12)Flash Point: 325.8 °C; (13)Enthalpy of Vaporization: 94.6 kJ/mol; (14)Boiling Point: 615.1 °C at 760 mmHg; (15)Vapour Pressure: 1.01E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2c1c(ccc(O)c1)n3c4c2c(NCCCN(CC)CC)ccc4nc3
(2)InChI: InChI=1/C21H24N4O2/c1-3-24(4-2)11-5-10-22-16-7-8-17-20-19(16)21(27)15-12-14(26)6-9-18(15)25(20)13-23-17/h6-9,12-13,22,26H,3-5,10-11H2,1-2H3
(3)InChIKey: ZNCLTXLLRNQSPG-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C21H24N4O2/c1-3-24(4-2)11-5-10-22-16-7-8-17-20-19(16)21(27)15-12-14(26)6-9-18(15)25(20)13-23-17/h6-9,12-13,22,26H,3-5,10-11H2,1-2H3
(5)Std. InChIKey: ZNCLTXLLRNQSPG-UHFFFAOYSA-N

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