| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 10 | Yes |
Popular Name: 5-Cyclobutyl-4H-1,2,4-triazol-3-ylamine 5-Cyclobutyl-4H-1,2,4-triazol-3-…
Find On: PubMed — Wikipedia — Google
CAS Number: 496057-24-0
1H-1,2,4-Triazol-3-amine, 5-cyclobutyl- (9CI)
1H-1,2,4-triazol-5-amine, 3-cyclobutyl-
3-cyclobutyl-1H-1,2,4-triazol-5-amine
5-cyclobutyl-1H-1,2,4-triazol-3-amine
5-Cyclobutyl-2H-[1,2,4]triazol-3-ylamine
| 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) | -0.06 | 3.85 | -9.52 | 3 | 4 | 0 | 68 | 138.174 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.06 | 4.28 | -33.71 | 4 | 4 | 1 | 69 | 139.182 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 153-155° | Fluorochem |
| MP | 172 - 174 | Enamine Building Blocks |
| MP | 172...174 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
