Basic information
- Standard SMILES
Cc1nc(C(=O)O)c2nc(C3CCC(C)(C)CC3)sc2n1- InChIKey
HXBWAQCPGVAWNQ-UHFFFAOYSA-N- Molecular formula
- C15H19N3O2S
- Average molar mass
- 305.4 g/mol
Names & identifiers
- Preferred name
- 2-(4,4-Dimethylcyclohexyl)-5-methyl[1,3]thiazolo[5,4-d]pyrimidine-7-carboxylic acid
- IUPAC
- 2-(4,4-dimethylcyclohexyl)-5-methyl-[1,3]thiazolo[5,4-d]pyrimidine-7-carboxylic acid
Names & synonyms
SCHEMBL16653441HXBWAQCPGVAWNQ-UHFFFAOYSA-N2-(4,4-dimethylcyclohexyl)-5-methyl[1,3]thiazolo[5,4-d]pyrimidine-7-carboxylic acid
Database identifiers
- PubChem CID
- 118024031
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 408
Related reactions
1 records
Compound notes
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