4-(2-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Chemical Structure Depiction of
4-(2-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
4-(2-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Compound characteristics
| Compound ID: | 4222-0273 |
| Compound Name: | 4-(2-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C25 H24 N4 O2 |
| Smiles: | COc1ccccc1N1C(C2=C(c3ccccc3CC23CCCCC3)n2cnnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1078 |
| logD: | 4.1078 |
| logSw: | -4.3557 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.246 |
| InChI Key: | VISTWJCIKVULAB-UHFFFAOYSA-N |