2-{3-[(propan-2-yl)oxy]phenyl}-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
Chemical Structure Depiction of
2-{3-[(propan-2-yl)oxy]phenyl}-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
2-{3-[(propan-2-yl)oxy]phenyl}-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane]
Compound characteristics
| Compound ID: | D325-0482 |
| Compound Name: | 2-{3-[(propan-2-yl)oxy]phenyl}-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclohexane] |
| Molecular Weight: | 424.55 |
| Molecular Formula: | C27 H28 N4 O |
| Smiles: | CC(C)Oc1cccc(c1)c1nc2C3=C(c4ccccc4CC34CCCCC4)N=Cn2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.9834 |
| logD: | 3.6099 |
| logSw: | -5.546 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.334 |
| InChI Key: | RNFVWHATSCTWQR-UHFFFAOYSA-N |