| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 12 | Yes |
Popular Name: 4-Methoxy-2(3h)-benzothiazolone 4-Methoxy-2(3h)-benzothiazolone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 80567-66-4 , [80567-66-4]
2(3H)-Benzothiazolone, 4-methoxy-
2(3H)-Benzothiazolone, 4-methoxy- (9CI)
4-Methoxy-benzo[d]thiazol-2(3H)-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) | 1.83 | 2.03 | -7.81 | 1 | 3 | 0 | 42 | 181.216 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 0.04 | -48.35 | 0 | 3 | -1 | 45 | 180.208 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.