| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2004 | 23 | No |
Popular Name: 2-Mercapto-3,5-diphenyl-3H-thieno[2,3-d]pyrimidin-4-one 2-Mercapto-3,5-diphenyl-3H-thien…
Find On: PubMed — Wikipedia — Google
CAS Number: 142465-09-6
3,5-diphenyl-2-sulfanyl-3H,4H-thieno[2,3-d]pyrimidin-4-one
3,5-diphenyl-2-thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one
3,5-Diphenyl-2-thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-one, 96%
| 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) | 3.80 | 11.35 | -15.02 | 1 | 3 | 0 | 38 | 336.441 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.25 | 10.92 | -44.35 | 0 | 3 | -1 | 41 | 335.433 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 275-277? | Alfa-Aesar |
| Melting_Point | 275-277° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
