| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 22 | Yes |
Popular Name: 5-Cyano-2-[4-butoxycarbonyl-1-(1,4-diazepenyl)]pyridine 5-Cyano-2-[4-butoxycarbonyl-1-(1…
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CAS Numbers: 683274-60-4 , [683274-60-4]
5-Cyano-2-[4-butoxycarbonyl-1-(1,4-diazepenyl)]
5-Cyano-2-[4-butoxycarbonyl-1-(1,4-diazepenyl)]-pyridine
tert-Butyl 4-(5-cyanopyridin-2-yl)-1,4-diazepane-1-carboxylate
tert-Butyl4-(5-cyanopyridin-2-yl)-1,4-diazepane-1-carboxylate
| 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) | 2.10 | 8.05 | -10.72 | 0 | 6 | 0 | 69 | 302.378 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 95-99° | Oakwood Chemical |
