| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2008 | 16 | Yes |
Popular Name: 4-(4-Ethyl-piperazin-1-ylmethyl)-phenylamine 4-(4-Ethyl-piperazin-1-ylmethyl)…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 611225-86-6 , [611225-86-6]
4-(4-ethylpiperazin-1-ylmethyl)phenylamine
4-[(4-ethylpiperazin-1-yl)methyl]aniline
Benzenamine, 4-[(4-ethyl-1-piperazinyl)methyl]- (9CI)
| 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) | 1.09 | 4.44 | -33.58 | 3 | 3 | 1 | 34 | 220.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.09 | 4.45 | -32.96 | 3 | 3 | 1 | 34 | 220.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.09 | 2.13 | -4.04 | 2 | 3 | 0 | 32 | 219.332 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 72 - 74 | Enamine Building Blocks |
| MP | 72...74 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
