In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2008 | 13 | No |
Popular Name: 3-Oxo-3,4-dihydro-2H-benzo[1,4]oxazine-6-carbaldehyde 3-Oxo-3,4-dihydro-2H-benzo[1,4]o…
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CAS Numbers: 200195-15-9 , [200195-15-9]
2H-1,4-benzoxazine-6-carboxaldehyde, 3,4-dihydro-3-oxo-
3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carbaldehyde
3-Oxo-3,4-dihydro-2H-benzo[1,4]oxazine-6-
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.75 | 1.47 | -10.07 | 1 | 4 | 0 | 55 | 177.159 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 97% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.