| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 15 | Yes |
Popular Name: ethyl 4-amino-3-methylthieno[2,3-c]isothiazole-5-carboxylate ethyl 4-amino-3-methylthieno[2,3…
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CAS Numbers: 82000-54-2 , [82000-54-2]
ethyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate
ethyl4-amino-3-methylthieno[2,3-c]isothiazole-5-carboxylate
| 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) | 2.21 | -1.92 | -9.43 | 2 | 4 | 0 | 65 | 242.325 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 134 - 136 | KeyOrganics |
| MP | 134-136° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.