| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 18 | Yes |
Popular Name: 1-[3-(Trifluoromethyl)benzyl]piperidin-4-amine 1-[3-(Trifluoromethyl)benzyl]pip…
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CAS Numbers: 1211512-12-7 , 66898-97-3
1-[3-(trifluoromethyl)benzyl]-4-piperidinylamine dihydrochloride
1-[3-(Trifluoromethyl)benzyl]piperidin-4-amine dihydrochloride
1-{[3-(trifluoromethyl)phenyl]methyl}piperidin-4-amine
4-piperidinamine, 1-[[3-(trifluoromethyl)phenyl]methyl]-, dihydrochloride
| 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) | 1.88 | 4.26 | -43.5 | 3 | 2 | 1 | 31 | 259.295 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 6.42 | -113.59 | 4 | 2 | 2 | 32 | 260.303 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
