Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC1=NC2(c3cccc(N=[N+]=[N-])c3)CCOCC2CS1- InChIKey
BAXLGEQTOHZABZ-UHFFFAOYSA-N- Molecular formula
- C18H23N5O3S
- Average molar mass
- 389.5 g/mol
- Monoisotopic mass
- 389.15216079
Names & identifiers
- IUPAC
- tert-butyl N-[8a-(3-azidophenyl)-4a,5,7,8-tetrahydro-4H-pyrano[4,3-d][1,3]thiazin-2-yl]carbamate
Database identifiers
- PubChem CID
- 76550585
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 99.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 643
Related reactions
1 records
Compound notes
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