| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 15 | No |
Popular Name: 3-Ethyl-2-mercapto-5,6-dimethyl-3H-thieno-[2,3-d]pyrimidin-4-one 3-Ethyl-2-mercapto-5,6-dimethyl-…
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CAS Numbers: 59898-60-1 , [59898-60-1]
3-Ethyl-2-mercapto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one
3-ethyl-2-mercapto-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
3-ethyl-5,6-dimethyl-2-sulfanyl-3H,4H-thieno[2,3-d]pyrimidin-4-one
3-ethyl-5,6-dimethyl-2-thioxo-2,3-dihydrothieno[2,3-d]pyrimidin-4(1H)-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) | 1.77 | 6.75 | -10.21 | 1 | 3 | 0 | 38 | 240.353 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 6.3 | -37.71 | 0 | 3 | -1 | 41 | 239.345 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 257-259° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
