| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 15 | Yes |
Popular Name: Methyl 3-amino-4-fluorobenzo[b]thiophene-2-carboxylate Methyl 3-amino-4-fluorobenzo[b]t…
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CAS Numbers: 144899-95-6 , [144899-95-6]
3-Amino-4-fluoro-benzo[b]thiophene-2-carboxylic acid methyl ester
benzo[b]thiophene-2-carboxylic acid, 3-amino-4-fluoro-, methyl ester
methyl 3-amino-4-fluoro-1-benzothiophene-2-carboxylate
Methyl 3-amino-4-fluorobenzo-[b]thiophene-2-carboxylate
Methyl 3-amino-4-fluorobenzo[b]thiophene-2-
| 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) | 2.50 | 0.3 | -8.13 | 2 | 3 | 0 | 52 | 225.244 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 78-82° | Oakwood Chemical |
| MP | 78-82°C | Fluorochem |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.