CAS 54933-35-6
:(2S,3R)-5-[(2S)-3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydro-2,3-naphthalenediol
Description:
The chemical substance with the name "(2S,3R)-5-[(2S)-3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydro-2,3-naphthalenediol" and CAS number "54933-35-6" is characterized by its complex molecular structure, which includes a naphthalene core and multiple functional groups. This compound features stereocenters, indicated by its (2S,3R) configuration, which contributes to its three-dimensional shape and potential biological activity. The presence of a hydroxyl group and an amino group suggests that it may engage in hydrogen bonding, influencing its solubility and reactivity. The tert-butyl group (1,1-Dimethylethyl) enhances its lipophilicity, potentially affecting its pharmacokinetic properties. This compound may be of interest in medicinal chemistry due to its structural features, which could interact with biological targets. Overall, its unique combination of functional groups and stereochemistry may confer specific properties that are relevant in pharmaceutical applications or research contexts.
Formula:C17H27NO4
InChI:InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/t12-,14-,15+/m0/s1
InChI key:InChIKey=VWPOSFSPZNDTMJ-AEGPPILISA-N
SMILES:O(C[C@H](CNC(C)(C)C)O)C1=C2C(C[C@H](O)[C@H](O)C2)=CC=C1
Synonyms:- 2,3-Naphthalenediol, 5-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydro-, [2S-[2α,3α,5(R*)]]-
- (2S,3R)-5-[(2S)-3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydro-2,3-naphthalenediol
- SQ 12150
- 2,3-Naphthalenediol, 5-[(2S)-3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydro-, (2S,3R)-
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