| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2005 | 15 | Yes |
Popular Name: 3-bromo-4-(4-methylpiperazino)aniline 3-bromo-4-(4-methylpiperazino)an…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1803594-54-8 , 477846-55-2
3-bromo-4-(4-methylpiperazin-1-yl)aniline
| 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) | 1.74 | 5.97 | -34.6 | 3 | 3 | 1 | 34 | 271.182 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 3.63 | -3.11 | 2 | 3 | 0 | 32 | 270.174 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 120 - 122 | KeyOrganics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
