6-(Benzyloxy)-2-(methanesulfonyl)pyrimidin-4-amine
Basic information
- CAS
60722-77-2- Standard SMILES
CS(=O)(=O)c1nc(N)cc(OCc2ccccc2)n1- InChIKey
ZNXLCJLFAOBGLN-UHFFFAOYSA-N- Molecular formula
- C12H13N3O3S
- Average molar mass
- 279.32 g/mol
- Monoisotopic mass
- 279.06776246
Names & identifiers
- Preferred name
- 6-(Benzyloxy)-2-(methanesulfonyl)pyrimidin-4-amine
- IUPAC
- 2-methylsulfonyl-6-phenylmethoxypyrimidin-4-amine
Names & synonyms
60722-77-2NSC2103266-(Benzyloxy)-2-(methanesulfonyl)pyrimidin-4-amineCHEMBL3273661DTXSID80308879NSC-210326DS-0134712-Methylsulfonyl-6-phenylmethoxy-pyrimidin-4-amine
Database identifiers
- CAS
60722-77-2- PubChem CID
- 308514
- DTXSID
DTXSID80308879- ChEMBL
CHEMBL3273661
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 376
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…