Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CC2CC(c3cnc(OCCO[Si](C)(C)C(C)(C)C)s3)=C(C(=O)N(Cc3cccc(Cl)c3Cl)C3CC3)C(C1)N2C(=O)OC(C)(C)C- InChIKey
DEOVKIXCGQNCNL-UHFFFAOYSA-N- Molecular formula
- C39H56Cl2N4O7SSi
- Average molar mass
- 823.9 g/mol
Names & identifiers
- Preferred name
- 7-{2-[2-(tert-Butyldimethylsilanyloxy)ethoxy]thiazol-5-yl}-6-[cyclo-propyl-(2,3-dichlorobenzyl)carbamoyl]-3,9-diazabicyclo[3.3.1]non-6-ene-3,9-dicarboxylic acid di-tert-butyl ester
- IUPAC
- ditert-butyl 7-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-1,3-thiazol-5-yl]-6-[cyclopropyl-[(2,3-dichlorophenyl)methyl]carbamoyl]-3,9-diazabicyclo[3.3.1]non-6-ene-3,9-dicarboxylate
Names & synonyms
SCHEMBL3258701DEOVKIXCGQNCNL-UHFFFAOYSA-N7-{2-[2-(tert-Butyldimethylsilanyloxy)ethoxy]thiazol-5-yl}-6-[cyclo-propyl-(2,3-dichlorobenzyl)carbamoyl]-3,9-diazabicyclo[3.3.1]non-6-ene-3,9-dicarboxylic acid di-tert-butyl ester
Database identifiers
- PubChem CID
- 68570780
Properties
Computed structural properties
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 15
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 1,410
Related reactions
2 records
Compound notes
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