The 7H-Pyrrolo[2,3-d]pyrimidin-4-amine sulphate, with the CAS registry number 769951-32-8, is also called 4-Amino-7H-pyrrolo[2,3-d]pyrimidine hydrogen sulfate. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C6H8N4O4S.
The characteristics of 7H-Pyrrolo[2,3-d]pyrimidin-4-amine sulphate are as followings: (1)# of Rule of 5 Violations: 1; (2)#H bond acceptors: 8; (3)#H bond donors: 5; (4)#Freely Rotating Bonds: 0; (5)Polar Surface Area: 94.93Å2.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=S(=O)(O)O.n1c(c2c(nc1)ncc2)N
(2)InChI: InChI=1/C6H6N4.H2O4S/c7-5-4-1-2-8-6(4)10-3-9-5;1-5(2,3)4/h1-3H,(H3,7,8,9,10);(H2,1,2,3,4)
(3)InChIKey: ZVFLCRGXDSPVKK-UHFFFAOYAA
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