Basic information
- Standard SMILES
Clc1nc(SCc2ccccc2)nc2nc(NCCOc3ccccc3)sc12- InChIKey
WAXTYCWVZHTBGO-UHFFFAOYSA-N- Molecular formula
- C20H17ClN4OS2
- Average molar mass
- 429 g/mol
Names & identifiers
- Preferred name
- 7-Chloro-N-(2-phenoxyethyl)-5-[(phenylmethyl)thio]-thiazolo[4,5-d]pyrimidin-2-amine
- IUPAC
- 5-benzylsulfanyl-7-chloro-N-(2-phenoxyethyl)-[1,3]thiazolo[4,5-d]pyrimidin-2-amine
Names & synonyms
SCHEMBL6866495WAXTYCWVZHTBGO-UHFFFAOYSA-N7-Chloro-N-(2-phenoxyethyl)-5-[(phenylmethyl)thio]-thiazolo[4,5-d]pyrimidin-2-amine
Database identifiers
- PubChem CID
- 22649152
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 465
Related reactions
2 records
Compound notes
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