| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 1st, 2008 | 30 | No |
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1017782-70-5 , N/A , [1017782-70-5]
Benzyl 4-(N-(2-bromoethyl)-N-(tert-butoxycarbonyl)sulfamoyl)piperazine-1-carboxylate
Benzyl 4-{[(2-bromoethyl)(tert-butoxycarbonyl)amin o]sulfonyl}tetrahydro-1(2H)-pyrazinecarboxylate
benzyl4-{[(2-bromoethyl)(tert-butoxycarbonyl)amino]sulfonyl}tetrahydro-1(2h)-pyrazinecarboxylate
BENZYLBROMOETHYLBUTOXYCARBONYLAMINOSULFONYLTETRAHYDROPYRAZINECARBOXYLAT
| 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) | 2.83 | 8.27 | -12 | 0 | 9 | 0 | 96 | 506.419 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 1.250000000000000e+002 - 1.260000000000000e+002 | KeyOrganics |
| melting_point | 125 - 126 | KeyOrganics |
| MP | 125-126° | Matrix Scientific |
| Purity | >90% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
