| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 22 | No |
Popular Name: 1-[4-(Methylsulfonyl)-2-nitrophenyl]piperidine-4-carboxamide 1-[4-(Methylsulfonyl)-2-nitrophe…
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CAS Numbers: 849035-88-7 , [849035-88-7]
1-[4-(Methylsulfonyl)-2-nitrophenyl]piperidine-4-
1-[4-(Methylsulphonyl)-2-nitrophenyl]piperidine-4-carboxamide
| 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) | 0.30 | -5.24 | -23.82 | 2 | 8 | 0 | 126 | 327.362 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 197 - 198° | Fluorochem |
| MP | 197-198° | Matrix Scientific |
| Purity | 95%+ | Fluorochem |
| Warnings | Irritant | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.