chempirical

N-((2R,3R,4S,5R)-6-((tert-Butyldiphenylsilyl)oxy)-1,3,4,5-tetrahydroxyhexan-2-yl)acetamide

C24H35NO6SiCAS 676227-13-7461.63 g/mol

Open in Covalent MOL file
OHNOHOSiOHHOOH
AlcoholAmideSilyl ether

Properties

Molecular formula
C24H35NO6Si
Molar mass
461.63 g/mol
Exact mass
461.2234 Da
logP
0.14Crippen estimate
Polar surface area
119.3 Ų
H-bond donors / acceptors
5 / 6
Rotatable bonds
10
Stereocentres
R, R, S, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
676227-13-7
SMILES
CC(=O)N[C@H](CO)[C@H]([C@@H]([C@@H](CO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)O)O)O
InChIKey
ZXECPVQQUYSCDZ-SSGKUCQKSA-N
InChI
InChI=1S/C24H35NO6Si/c1-17(27)25-20(15-26)22(29)23(30)21(28)16-31-32(24(2,3)4,18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,20-23,26,28-30H,15-16H2,1-4H3,(H,25,27)/t20-,21-,22-,23-/m1/s1

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Work with N-((2R,3R,4S,5R)-6-((tert-Butyldiphenylsilyl)oxy)-1,3,4,5-tetrahydroxyhexan-2-yl)acetamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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