Thiazolo[5,4-d]pyrimidine, 5-(benzylamino)-
Basic information
- CAS
19835-22-4- Standard SMILES
c1ccc(CNc2ncc3ncsc3n2)cc1- InChIKey
YFGQDRNVQKOCAW-UHFFFAOYSA-N- Molecular formula
- C12H10N4S
- Average molar mass
- 242.3 g/mol
- Monoisotopic mass
- 242.06261751
Names & identifiers
- Preferred name
- Thiazolo[5,4-d]pyrimidine, 5-(benzylamino)-
- IUPAC
- N-benzyl-[1,3]thiazolo[5,4-d]pyrimidin-5-amine
- English name
- 5-(Benzylamino)thiazolo[5,4-d]pyrimidine
- Molecular formula
- C12H10N4S
- Molecular weight
- 242.3
Names & synonyms
Thiazolo[5,4-d]pyrimidine, 5-(benzylamino)-N-benzyl-[1,3]thiazolo[5,4-d]pyrimidin-5-amine19835-22-4DTXSID40347108YFGQDRNVQKOCAW-UHFFFAOYSA-NN-Benzyl[1,3]thiazolo[5,4-d]pyrimidin-5-amineN-Benzyl[1,3]thiazolo[5,4-d]pyrimidin-5-amine #5-(Benzylamino)thiazolo[5,4-d]pyrimidineThiazolo[5,4-d]pyrimidin-5-amine, N-(phenylmethyl)-
Database identifiers
- CAS
19835-22-4- PubChem CID
- 617951
- DTXSID
DTXSID40347108- Nikkaji
- J103.071J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 245
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Compound notes
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