| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 23 | Yes |
Popular Name: ethyl 5-cyano-2-[4-(2-hydroxyethyl)piperazino]-6-methylnicotinate ethyl 5-cyano-2-[4-(2-hydroxyeth…
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CAS Numbers: 924869-05-6 , N/A
Ethyl 5-cyano-2-(4-(2-hydroxyethyl)piperazin-1-yl)-6-methylnicotinate
Ethyl 5-cyano-2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methylnicotinate
ethyl-5-cyano-2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methylnicotinate
ethyl5-cyano-2-[4-(2-hydroxyethyl)piperazino]-6-methylnicotinate
| 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) | 0.68 | 3.49 | -8.47 | 1 | 7 | 0 | 90 | 318.377 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.68 | 5.87 | -38.93 | 2 | 7 | 1 | 91 | 319.385 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 9.500000000000000e+001 - 9.700000000000000e+001 | KeyOrganics |
| melting_point | 95 - 97 | KeyOrganics |
| MP | 95-97° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
