1-[4-[2-[6-amino-8-[(6-bromo-1,3-benzodioxol-5-yl)sulfanyl]purin-9-yl]ethyl]piperidin-1-yl]-2-[tert-butyl(diphenyl)silyl]oxypropan-1-one

HCID 178477181
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Basic information

Standard SMILES
CC(O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(=O)N1CCC(CCn2c(Sc3cc4c(cc3Br)OCO4)nc3c(N)ncnc32)CC1
InChIKey
WIBZTABSRUSCHX-UHFFFAOYSA-N
Molecular formula
C38H43BrN6O4SSi
Average molar mass
787.8 g/mol
Monoisotopic mass
786.20191

Names & identifiers

IUPAC
1-[4-[2-[6-amino-8-[(6-bromo-1,3-benzodioxol-5-yl)sulfanyl]purin-9-yl]ethyl]piperidin-1-yl]-2-[tert-butyl(diphenyl)silyl]oxypropan-1-one

Database identifiers

PubChem CID
76642920

Properties

Computed structural properties

Topological polar surface area
143 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
11
Heavy atoms
51

Related reactions

1 records
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Compound notes

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