| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 14 | No |
Popular Name: 3-Allyl-2-mercaptothieno[3,2-d]pyrimidin-4(3h)-one 3-Allyl-2-mercaptothieno[3,2-d]p…
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CAS Number: 120079-81-4
3-(prop-2-en-1-yl)-2-sulfanyl-3H,4H-thieno[3,2-d]pyrimidin-4-one
3-allyl-2-sulfanylthieno[3,2-d]pyrimidin-4(3H)-one
3-Allyl-2-thioxo-2,3-dihydro-1H-thieno[3,2-d]pyrimidin-4-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) | 1.44 | 5.81 | -12.64 | 1 | 3 | 0 | 38 | 224.31 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.90 | 5.38 | -39.09 | 0 | 3 | -1 | 41 | 223.302 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
