| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 15 | Yes |
Popular Name: 4-(4-methylpiperazin-1-ylmethyl)phenylamine 4-(4-methylpiperazin-1-ylmethyl)…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 148120-37-0 , 70261-82-4 , N/A , [70261-82-4]
4-((4-Methylpiperazin-1-yl)methyl)aniline
4-(4-Methyl-piperazin-1-ylmethyl)-phenylamine
4-[(4-methylpiperazin-1-yl)methyl]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) | 0.71 | 3.7 | -33.68 | 3 | 3 | 1 | 34 | 206.313 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 3.58 | -32.69 | 3 | 3 | 1 | 34 | 206.313 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 1.33 | -3.15 | 2 | 3 | 0 | 32 | 205.305 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| MP | 96 - 98 | Enamine Building Blocks |
| MP | 96...98 | Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
