In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 16 | Yes |
Popular Name: 4-(4-fluorophenyl)-2-oxo-1,2-dihydro-3-pyridinecarbonitrile 4-(4-fluorophenyl)-2-oxo-1,2-dih…
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CAS Numbers: 886360-84-5 , N/A
1,2-Dihydro-4-(4-fluorophenyl)-2-oxopyridine-3-carbonitrile
4-(4-Fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
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) | 1.96 | 5.38 | -20.67 | 1 | 3 | 0 | 57 | 214.199 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 284 - 285 | KeyOrganics |
MP | 284-285° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.