| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2012 | 14 | Yes |
Popular Name: tert-Butyl 1,6-diazaspiro[3.3]heptane-1-carboxylate tert-Butyl 1,6-diazaspiro[3.3]he…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1330763-95-5 , 1394319-56-2 , 1523571-10-9
1-BOC-1,6-DIAZASPIRO[3.3]HEPTANE OXALATE
3,6-Diazaspiro[3.3]heptane-3-carboxylic acid tert-butyl ester
3,6-Diazaspiro[3.3]heptane-3-carboxylic acidtert-butyl ester
DIAZASPIROHEPTANECARBOXYLICACIDTERTBUTYLESTE
tert-Butyl 1,6-diazaspiro[3.3]heptane-1-carboxylate oxalate
tert-Butyl 1,6-diazaspiro[3.3]heptane-1-carboxylate oxalate(2:1)
| 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) | 1.21 | 2.67 | -42.24 | 2 | 4 | 1 | 46 | 199.274 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 0.94 | -6.71 | 1 | 4 | 0 | 42 | 198.266 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
![3,6-diazaspiro[3.3]heptane](http://zinc12.docking.org/img/rings/76205.gif)