| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 16 | No |
Popular Name: (5E)-2-mercapto-5-(4-methoxybenzylidene)-1,3-thiazol-4(5H)-one (5E)-2-mercapto-5-(4-methoxybenz…
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CAS Numbers: 5462-97-5; 81154-16-7; 81154-17-8 , 81154-16-7
(E)-2-Mercapto-5-(4-methoxybenzylidene)thiazol-4(5H)-one
4-thiazolidinone, 5-[(4-methoxyphenyl)methylene]-2-thioxo-, (5E)-
5-(4-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
5-[(4-methoxyphenyl)methylene]-2-thioxo-1,3-thiazolan-4-one
| 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) | 2.34 | 3.7 | -39.48 | 0 | 3 | -1 | 45 | 250.324 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 4.79 | -9.86 | 1 | 3 | 0 | 42 | 251.332 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
