In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 17th, 2004 | 12 | No |
Popular Name: 4-(3-bromo-2-thienyl)-1,3-thiazol-2-amine 4-(3-bromo-2-thienyl)-1,3-thiazo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 81216-90-2 , [81216-90-2]
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) | 2.67 | -2.84 | -6.76 | 2 | 2 | 0 | 38 | 261.169 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | -2.68 | -25.71 | 3 | 2 | 1 | 40 | 262.177 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 143 - 146 | KeyOrganics |
MP | 151 - 153 | Enamine Building Blocks |
MP | 151...153 | Enamine Building Blocks |
MP | 154-156° | Matrix Scientific |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |