Products Categories
CAS No.: | 1092788-83-4 |
---|---|
Name: | 1-Cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C17H17N7 |
Molecular Weight: | 319.36 |
Synonyms: | PP 121; |
Density: | 1.64 g/cm3 |
Boiling Point: | 650.889 °C at 760 mmHg |
Flash Point: | 347.446 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22 |
PSA: | 98.30000 |
LogP: | 3.64810 |
What can I do for you?
Get Best Price
The CAS registry number of 1H-Pyrazolo[3,4-d]pyrimidin-4-amine,1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)- is 1092788-83-4. The systematic name is 1-cyclopentyl-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine. In addition, the molecular formula is C17H17N7 and the molecular weight is 319.36. What's more, it should be stored in a cool and dry place.
Physical properties about this chemical are: (1)ACD/LogP: 2.46; (2)ACD/LogD (pH 5.5): 2.446; (3)ACD/LogD (pH 7.4): 2.461; (4)ACD/BCF (pH 5.5): 42.18; (5)ACD/BCF (pH 7.4): 43.721; (6)ACD/KOC (pH 5.5): 501.63; (7)ACD/KOC (pH 7.4): 519.95; (8)#H bond acceptors: 7; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 98.3 Å2; (12)Index of Refraction: 1.881; (13)Molar Refractivity: 89.287 cm3; (14)Molar Volume: 194.79 cm3; (15)Polarizability: 35.396 ×10-24cm3; (16)Surface Tension: 76.904 dyne/cm; (17)Density: 1.64 g/cm3; (18)Flash Point: 347.446 °C; (19)Enthalpy of Vaporization: 95.926 kJ/mol; (20)Boiling Point: 650.889 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: c1c[nH]c2c1cc(cn2)c3c4c(ncnc4n(n3)C5CCCC5)N
(2)InChI: InChI=1/C17H17N7/c18-15-13-14(11-7-10-5-6-19-16(10)20-8-11)23-24(12-3-1-2-4-12)17(13)22-9-21-15/h5-9,12H,1-4H2,(H,19,20)(H2,18,21,22)
(3)InChIKey: NVRXTLZYXZNATH-UHFFFAOYAJ