| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2008 | 21 | Yes |
Popular Name: (1R,2R)-N-Methanesulfonyl-1,2-diphenylethanediamine (1R,2R)-N-Methanesulfonyl-1,2-di…
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CAS Numbers: 300345-76-0 , 511534-44-4
(1R,2R)-N-Methylsulfonyl-1,2-diphenylethanediamine
(1R,2R)-N-Methylsulfonyl-1,2-diphenylethanediamine, 98+%
| 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) | 0.13 | 3.13 | -52.44 | 4 | 5 | 1 | 83 | 307.395 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.13 | 2.99 | -38.94 | 2 | 5 | -1 | 83 | 305.379 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 2.78 | -10.19 | 3 | 5 | 0 | 81 | 306.387 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 117-119? | Alfa-Aesar |
| Melting_Point | 117-119° | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.