3(4H)-Quinazolineacetamide, N-cyclohexyl-4-oxo-2-(phenoxymethyl)-
Basic information
- CAS
85063-17-8- Standard SMILES
O=C(Cn1c(COc2ccccc2)nc2ccccc2c1=O)NC1CCCCC1- InChIKey
ZRXDQZBAUYRSJY-UHFFFAOYSA-N- Molecular formula
- C23H25N3O3
- Average molar mass
- 391.5 g/mol
- Monoisotopic mass
- 391.18959167
Names & identifiers
- Preferred name
- 3(4H)-Quinazolineacetamide, N-cyclohexyl-4-oxo-2-(phenoxymethyl)-
- IUPAC
- N-cyclohexyl-2-[4-oxo-2-(phenoxymethyl)quinazolin-3-yl]acetamide
- English name
- 3(4H)-Quinazolineacetamide, N-cyclohexyl-4-oxo-2-(phenoxymethyl)-
- Molecular formula
- C23H25N3O3
- Molecular weight
- 391.46
Names & synonyms
85063-17-83(4H)-Quinazolineacetamide, N-cyclohexyl-4-oxo-2-(phenoxymethyl)-N-Cyclohexyl-4-oxo-2-(phenoxymethyl)-3(4H)-quinazolineacetamideDTXSID60234122RefChem:269717DTXCID60156613N-Cyclohexyl-2-(4-oxo-2-(phenoxymethyl)quinazolin-3(4H)-yl)acetamideN-cyclohexyl-2-[4-oxo-2-(phenoxymethyl)-3,4-dihydroquinazolin-3-yl]acetamideN-Cyclohexyl-2-[4-oxo-2-(phenoxymethyl)quinazolin-3(4H)-yl]acetamide
Database identifiers
- CAS
85063-17-8- PubChem CID
- 3069713
- DTXSID
DTXSID60234122
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 71 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 608
Physicochemical properties
- Density
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- pka
- 14.08 · 14.08±0.20(Predicted)
- EWG's Food Scores
- 1 · 1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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