Chemical Properties of erythro-1-(4',5'-dihydroxyhexyl)-3,7-dimethylxanthine, O-TFA

erythro-1-(4',5'-dihydroxyhexyl)-3,7-dimethylxanthine, O-TFA

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InChI
InChI=1S/C17H18F6N4O6/c1-8(32-13(29)16(18,19)20)9(33-14(30)17(21,22)23)5-4-6-27-12(28)10-11(24-7-25(10)2)26(3)15(27)31/h7-9H,4-6H2,1-3H3/t8-,9+/m0/s1
InChI Key
IKPRVZPOMULNJV-DTWKUNHWSA-N
Formula
C17H18F6N4O6
SMILES
CC(OC(=O)C(F)(F)F)C(CCCn1c(=O)c2c(ncn2C)n(C)c1=O)OC(=O)C(F)(F)F
Molecular Weight1
488.34
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Physical Properties

Property Value Unit Source
log10WS -7.35 Crippen Calculated Property
logPoct/wat 1.182 Crippen Calculated Property
McVol 288.630 ml/mol McGowan Calculated Property
Inp [2248.00; 2248.00]   Show Hide
Inp 2248.00 NIST
Inp 2248.00 NIST

Similar Compounds

threo-1-(4',5'-dihydroxyhexyl)-3,7-dimethylxanthine, O-TFA. 1-(5',6'-dihydroxyhexyl)-3,7-dimethylxanthine, O-TFA. 1-(5'-hydroxyhexyl)-3,7-dimethylxanthine, O-TFA. Adenosine, 2'-deoxy-N-(trimethylsilyl)-3'-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. Xanthine, 1-(5'-hydroxyhexyl)-3-methyl-7-propyl, TFA. N6-(cyclotetramethylene-tertbutylsilyl)-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. 2'-Deoxyadenosine, 3',5',N6-tris(O-TMTBSi). Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. 2'-Deoxyinosine, tris(tert-butyldimethylsilyl) derivative. Hydromorphone, trimethylsilyl ether. Codeine-propionyl. cis-1,2-Indanediol, ferrocenylboronate. Ajmaline. Galantamin. 3-propionyl-morphine.

Find more compounds similar to erythro-1-(4',5'-dihydroxyhexyl)-3,7-dimethylxanthine, O-TFA.

Sources

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