| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2007 | 14 | Yes |
Popular Name: 3H-Benzo[4,5]furo[3,2-d]pyrimidin-4-one 3H-Benzo[4,5]furo[3,2-d]pyrimidi…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 39786-36-2 , [39786-36-2]
(R)-2-Pyrrolidineboronic acid (+)-pinanediol ester hydrochloride; >
4-Hydroxybenzofuro[3,2-d]pyrimidine
4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-4(3H)-one
8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,10,12-pentaen-6-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) | 1.41 | 3.95 | -17.4 | 1 | 4 | 0 | 59 | 186.17 | 0 | ↓ |
| Mid Mid (pH 6-8) | 1.87 | 1.84 | -52.32 | 0 | 4 | -1 | 62 | 185.162 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 300 - 302 | Enamine Building Blocks |
| MP | 300...302 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
