In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 11 | Yes |
Popular Name: 4-Chloro-2-(methylthio)pyrimidine-5-carbonitrile 4-Chloro-2-(methylthio)pyrimidin…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 240800-45-7 , 33089-15-5 , [33089-15-5]
"4-Chloro-2-(methylthio)pyrimidine-5-carbonitrile, 97%"
4-chloro-2-(methylsulfanyl)pyrimidine-5-carbonitrile
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) | 2.03 | 3.73 | -5.72 | 0 | 3 | 0 | 50 | 185.639 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.