Pyrimidine, 3,4,5,6-tetrahydro-2-(3-fluoro-4-methoxy-alpha-phenoxybenzyl)-
Basic information
- CAS
52963-62-9- Standard SMILES
COc1ccc(C(Oc2ccccc2)C2=NCCCN2)cc1F- InChIKey
RPGDLEXGKWFLOV-UHFFFAOYSA-N- Molecular formula
- C18H19FN2O2
- Average molar mass
- 314.4 g/mol
- Monoisotopic mass
- 314.14305602
Names & identifiers
- Preferred name
- Pyrimidine, 3,4,5,6-tetrahydro-2-(3-fluoro-4-methoxy-alpha-phenoxybenzyl)-
- IUPAC
- 2-[(3-fluoro-4-methoxyphenyl)-phenoxymethyl]-1,4,5,6-tetrahydropyrimidine
- English name
- 3,4,5,6-Tetrahydro-2-(3-fluoro-4-methoxy-α-phenoxybenzyl)pyrimidine
- Molecular formula
- C18H19FN2O2
- Molecular weight
- 314.35
Names & synonyms
52963-62-92-(3-Fluoro-4-methoxy-alpha-phenoxybenzyl)-3,4,5,6-tetrahydropyrimidine3,4,5,6-Tetrahydro-2-(3-fluoro-4-methoxy-alpha-phenoxybenzyl)pyrimidinePyrimidine, 3,4,5,6-tetrahydro-2-(3-fluoro-4-methoxy-alpha-phenoxybenzyl)-RefChem:3775622-[(3-fluoro-4-methoxyphenyl)(phenoxy)methyl]-1,4,5,6-tetrahydropyrimidineDTXSID30967435DB-2938223,4,5,6-Tetrahydro-2-(3-fluoro-4-methoxy-α-phenoxybenzyl)pyrimidinePyrimidine, 2-[(3-fluoro-4-methoxyphenyl)phenoxymethyl]-1,4,5,6-tetrahydro-
Database identifiers
- CAS
52963-62-9- PubChem CID
- 103706
- DTXSID
DTXSID30967435- Nikkaji
- J86.985F
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 398
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…